data_2w85_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 2w85 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 C--O 1.234 0.31 0 CA-C-O 121.163 0.401 . . . . 0.0 112.269 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.44 ' HB3' ' HG2' ' A' ' 27' ' ' PRO . 92.5 mtt180 -135.88 139.09 43.1 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.778 -175.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.599 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 36.3 tt0 -61.36 -41.2 78.33 Favored Pre-proline 0 CA--C 1.54 0.57 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.275 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.599 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 5.0 Cg_endo -50.88 -30.74 31.21 Favored 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 122.061 1.84 . . . . 0.0 112.412 173.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 99.7 mt -68.5 -44.52 74.52 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 43.7 mm -58.62 -49.1 83.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.2 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.92 -47.37 83.03 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.14 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 32.1 m -64.34 -36.01 82.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.886 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.77 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -69.11 -49.51 56.48 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.401 -178.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 90.9 t -57.44 -42.24 80.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-O 120.751 0.31 . . . . 0.0 110.458 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.545 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.7 tmmm? -58.42 -48.11 81.76 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.995 174.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.631 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 80.1 t80 -56.7 -54.86 41.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.7 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.77 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 32.9 mt -58.05 -54.51 46.17 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.533 -174.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -93.59 20.31 7.53 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.656 -173.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -66.87 -53.9 27.69 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 174.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.2 p -172.48 -69.32 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.174 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -91.07 -21.54 21.18 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -167.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.475 ' HB ' ' HA ' ' A' ' 36' ' ' LEU . 40.1 t -67.29 -33.27 61.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.728 -173.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 36' ' ' LEU . 13.1 mmm180 -62.99 -28.49 70.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.019 0.437 . . . . 0.0 110.357 175.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -95.57 -6.32 40.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.976 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.2 t -80.11 136.78 53.48 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.012 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_exo -57.92 143.3 96.21 Favored 'Trans proline' 0 C--O 1.237 0.428 0 C-N-CA 122.963 2.442 . . . . 0.0 111.96 178.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.551 HD22 HH21 ' A' ' 49' ' ' ARG . 0.9 OUTLIER -68.72 -19.51 64.36 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.206 -176.953 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -53.29 -42.29 66.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.743 0.306 . . . . 0.0 110.337 172.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 84.7 m -71.22 -53.04 15.76 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.48 172.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.551 HH21 HD22 ' A' ' 46' ' ' LEU . 15.6 mtm180 -60.18 -34.2 73.27 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -169.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.431 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 6.1 mpp_? -67.67 -56.77 8.06 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 121.263 -0.175 . . . . 0.0 111.332 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.465 ' O ' ' HG3' ' A' ' 55' ' ' LYS . . . -59.7 -43.29 94.15 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 177.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.812 ' HD1' HD13 ' A' ' 53' ' ' LEU . 79.6 t80 -50.66 -66.92 0.3 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.414 -178.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.812 HD13 ' HD1' ' A' ' 52' ' ' PHE . 8.2 mp -60.32 -40.03 89.16 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.729 0.299 . . . . 0.0 111.292 -175.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.531 ' HA ' ' O ' ' A' ' 58' ' ' LEU . 60.1 mttm -63.24 -37.76 88.49 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.225 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' A' ' 51' ' ' ALA . 29.6 mtpp -78.64 -27.62 45.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.47 179.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.932 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 9.3 mmpt? -69.75 -25.29 63.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.205 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 135.65 2.54 2.84 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.157 -1.02 . . . . 0.0 113.02 177.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.531 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 5.8 mp -92.45 126.69 37.64 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.865 0.364 . . . . 0.0 110.459 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.2 p -70.4 173.63 6.66 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 116.244 -0.435 . . . . 0.0 109.952 174.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.6 ' O ' HG23 ' A' ' 63' ' ' ILE . 3.3 m-20 -56.25 -45.07 80.2 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.263 0.554 . . . . 0.0 110.392 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.443 ' O ' ' HG2' ' A' ' 65' ' ' MET . 10.3 pt-20 -56.3 -42.43 77.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.065 177.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -72.29 -33.59 67.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.424 -174.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.725 HG13 HD21 ' A' ' 53' ' ' LEU . 17.4 tt -69.71 -36.27 69.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 120.001 -0.679 . . . . 0.0 110.816 -177.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.66 -28.13 58.62 Favored 'General case' 0 C--O 1.211 -0.969 0 C-N-CA 119.072 -1.051 . . . . 0.0 109.316 173.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.797 ' HE3' ' HA ' ' A' ' 65' ' ' MET . 21.9 mmt -59.45 -51.88 68.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.806 0.336 . . . . 0.0 110.246 175.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.94 -42.29 99.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.074 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.504 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 6.8 m-85 -73.13 -29.05 62.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.941 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -71.48 -40.45 70.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.217 0.532 . . . . 0.0 109.8 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' A' ' 65' ' ' MET . 14.5 mm100 -69.95 -39.99 75.72 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.113 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 27.1 p -78.11 -24.28 47.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.022 0.439 . . . . 0.0 110.857 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 73.43 70.36 1.25 Allowed Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 121.091 -0.576 . . . . 0.0 113.151 174.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.0 p . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 110.218 -0.289 . . . . 0.0 110.218 174.834 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 78.2 tttt . . . . . 0 N--CA 1.457 -0.123 0 CA-C-O 120.804 0.335 . . . . 0.0 110.407 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -62.52 -32.52 73.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.523 178.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 106' ' ' PHE . . . . . 0.631 ' HD2' ' HZ ' ' A' ' 35' ' ' PHE . 62.1 m-85 -76.99 -26.67 54.15 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.435 0.636 . . . . 0.0 110.141 178.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -91.55 -61.44 1.64 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.841 -172.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -60.25 -45.83 91.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.614 -175.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . 0.545 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 34.6 tp -68.22 -30.92 70.09 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.532 -174.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 110' ' ' PHE . . . . . 0.616 ' HE2' ' HA ' ' A' ' 32' ' ' ALA . 8.5 t80 -92.45 -16.57 25.69 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.803 -177.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -59.37 -43.92 92.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.228 0.537 . . . . 0.0 110.051 176.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 37.6 m . . . . . 0 C--O 1.251 1.159 0 CA-C-N 115.219 -0.901 . . . . 0.0 109.538 177.698 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.763 ' HB2' ' HG3' ' A' ' 62' ' ' GLU . 96.5 Cg_endo . . . . . 0 N--CA 1.45 -1.04 0 CA-C-O 121.016 0.34 . . . . 0.0 112.411 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 66.8 mtm180 -134.01 169.8 16.58 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.979 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.544 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 8.8 tp10 -53.87 -50.9 81.3 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -176.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.544 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 10.2 Cg_endo -52.48 -28.26 35.25 Favored 'Trans proline' 0 C--N 1.36 1.154 0 C-N-CA 122.745 2.297 . . . . 0.0 113.359 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 57' ' ' GLY . 4.4 mm? -68.59 -44.78 73.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.781 0.324 . . . . 0.0 110.519 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.43 ' O ' HG21 ' A' ' 33' ' ' VAL . 46.2 mm -60.89 -49.89 82.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.479 -179.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.13 -47.69 80.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.502 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 28.1 m -65.99 -37.61 86.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.742 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.787 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -67.24 -48.51 67.58 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.042 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.43 HG21 ' O ' ' A' ' 29' ' ' ILE . 84.3 t -58.76 -42.58 85.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-O 120.552 0.215 . . . . 0.0 110.826 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.495 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.6 tmmm? -55.75 -46.01 77.94 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.274 0.559 . . . . 0.0 109.918 174.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.514 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 73.9 t80 -61.53 -52.61 63.75 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.718 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.946 ' HA ' HG12 ' A' ' 41' ' ' VAL . 54.5 mt -57.92 -37.57 74.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.042 -173.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -96.96 34.5 1.71 Allowed 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 120.836 0.351 . . . . 0.0 111.576 -177.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -94.06 28.69 2.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.157 0.503 . . . . 0.0 110.15 175.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.2 t 69.04 -67.47 0.21 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.704 176.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -64.92 -22.86 67.07 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.28 -175.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.946 HG12 ' HA ' ' A' ' 36' ' ' LEU . 40.9 t -68.73 -33.1 57.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -178.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -80.7 -18.26 48.46 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.044 0.449 . . . . 0.0 110.628 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -86.82 -35.34 19.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.323 0.582 . . . . 0.0 109.459 173.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.485 ' CB ' HH12 ' A' ' 49' ' ' ARG . 43.2 t -65.26 133.45 95.52 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.224 176.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -42.91 128.37 5.19 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 124.206 3.271 . . . . 0.0 114.272 -174.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.506 ' HA ' ' CG ' ' A' ' 49' ' ' ARG . 4.6 mp -64.57 -20.24 66.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.948 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -55.39 -44.17 75.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.435 173.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.1 m -67.14 -40.92 86.8 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.822 174.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.531 ' HB3' ' CZ ' ' A' ' 67' ' ' PHE . 16.9 mmp_? -52.59 -48.84 66.01 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.525 -174.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -58.68 -61.41 2.63 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.642 0.258 . . . . 0.0 111.633 -176.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.08 -42.12 97.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.782 -178.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.687 ' HD1' HD11 ' A' ' 53' ' ' LEU . 58.4 t80 -51.78 -58.22 7.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.258 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.814 HD21 HG13 ' A' ' 63' ' ' ILE . 8.0 mp -60.58 -44.89 95.69 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 121.049 -0.26 . . . . 0.0 111.221 -177.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.422 ' HZ2' ' CG ' ' A' ' 60' ' ' ASP . 94.8 mttt -67.46 -30.9 70.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.044 0.45 . . . . 0.0 111.544 -175.072 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.8 mmtm -78.54 -22.92 46.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.537 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.437 ' HD2' ' O ' ' A' ' 52' ' ' PHE . 1.0 OUTLIER -74.46 -41.31 61.0 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.587 175.733 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.52 ' O ' ' HG ' ' A' ' 28' ' ' LEU . . . 148.2 69.66 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.178 -1.011 . . . . 0.0 113.532 175.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.655 HD12 ' HB3' ' A' ' 53' ' ' LEU . 3.5 pp -166.1 150.82 8.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.854 0.359 . . . . 0.0 110.452 174.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.4 p -90.35 178.17 6.2 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.775 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.444 ' HA ' HG23 ' A' ' 63' ' ' ILE . 1.0 OUTLIER -55.23 -40.09 70.46 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -178.567 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -64.48 -35.64 81.59 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.001 0.429 . . . . 0.0 110.867 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.763 ' HG3' ' HB2' ' A' ' 24' ' ' PRO . 15.0 mm-40 -79.72 -29.1 40.56 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -177.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.814 HG13 HD21 ' A' ' 53' ' ' LEU . 11.6 tt -70.26 -37.06 70.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.043 -0.663 . . . . 0.0 111.083 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -77.47 -19.12 56.43 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 119.088 -1.045 . . . . 0.0 110.16 171.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.965 ' HE1' ' HA ' ' A' ' 65' ' ' MET . 0.7 OUTLIER -61.82 -46.15 90.73 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 171.874 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.83 -46.37 45.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.536 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.567 ' CD1' HD11 ' A' ' 36' ' ' LEU . 0.9 OUTLIER -71.06 -41.64 70.47 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -176.814 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -67.73 -42.57 81.66 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.966 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -61.22 -39.73 91.37 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.901 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.427 ' HB3' HG12 ' A' ' 33' ' ' VAL . 25.0 p -74.7 -6.93 51.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.869 0.366 . . . . 0.0 111.225 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 84.44 8.34 83.42 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 121.01 -0.614 . . . . 0.0 111.899 178.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.2 m . . . . . 0 C--N 1.323 -0.585 0 CA-C-O 120.889 0.376 . . . . 0.0 110.731 -177.2 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 62.6 tttp . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 121.16 0.505 . . . . 0.0 110.134 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -59.85 -35.55 75.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.348 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 106' ' ' PHE . . . . . 0.532 ' HB3' ' CE2' ' A' ' 52' ' ' PHE . 20.1 m-85 -77.13 -24.77 51.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.227 179.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -93.94 -59.12 2.05 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.784 -174.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.3 -30.73 71.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.816 -171.058 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . 0.495 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 87.6 mt -77.17 -29.54 54.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.705 0.288 . . . . 0.0 111.063 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 110' ' ' PHE . . . . . 0.405 ' CD1' ' HG2' ' A' ' 56' ' ' LYS . 1.1 t80 -90.19 -6.31 55.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.226 0.536 . . . . 0.0 110.19 -178.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -62.26 -52.5 63.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.409 177.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.249 1.051 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.502 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo . . . . . 0 N--CA 1.459 -0.511 0 CA-C-O 120.717 0.215 . . . . 0.0 112.258 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -134.03 142.61 47.67 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.231 0.538 . . . . 0.0 112.134 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.503 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 15.4 tp10 -55.16 -52.36 71.9 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 114.765 -1.107 . . . . 0.0 112.556 177.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 10.6 Cg_endo -55.43 -35.17 91.47 Favored 'Trans proline' 0 C--N 1.358 1.071 0 C-N-CA 122.371 2.047 . . . . 0.0 112.768 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 57' ' ' GLY . 0.6 OUTLIER -64.67 -44.18 91.2 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -178.538 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.1 mt -58.62 -42.97 86.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.484 178.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.04 -44.58 97.19 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.308 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.3 m -69.02 -35.24 76.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.859 178.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.559 ' O ' HD11 ' A' ' 36' ' ' LEU . . . -62.35 -45.12 94.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.195 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.7 t -67.5 -36.66 77.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.708 0.29 . . . . 0.0 110.38 178.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.579 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.5 tmtm? -56.8 -52.38 65.29 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.209 0.528 . . . . 0.0 109.594 173.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.511 ' O ' HG23 ' A' ' 41' ' ' VAL . 85.6 t80 -56.11 -51.96 66.02 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.043 177.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.559 HD11 ' O ' ' A' ' 32' ' ' ALA . 2.8 mp -52.08 -58.25 7.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.4 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -92.58 43.21 1.12 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.294 0.569 . . . . 0.0 111.828 -173.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -75.83 -56.62 4.5 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 167.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.8 p 173.16 -64.75 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.402 176.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.43 ' HE ' ' HB2' ' A' ' 40' ' ' ARG . 15.3 ttm180 -80.22 -25.73 39.48 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.728 -170.072 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 35' ' ' PHE . 74.0 t -58.13 -38.57 68.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -171.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.7 mtm180 -74.88 -11.83 60.22 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.921 0.391 . . . . 0.0 110.851 -177.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -106.69 2.16 25.6 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.111 0.482 . . . . 0.0 110.198 177.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 41.5 m -85.07 144.02 40.69 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.722 177.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -49.94 122.13 8.59 Favored 'Trans proline' 0 C--O 1.237 0.472 0 C-N-CA 122.964 2.443 . . . . 0.0 112.555 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.68 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 37.0 mt -62.55 -20.09 64.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.312 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -49.58 -49.09 47.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.835 0.35 . . . . 0.0 110.674 172.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.483 HG22 ' CZ ' ' B' ' 106' ' ' PHE . 63.6 m -70.42 -42.91 70.97 Favored 'General case' 0 C--O 1.22 -0.485 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 173.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.657 ' HB2' ' HA ' ' A' ' 46' ' ' LEU . 0.8 OUTLIER -53.34 -44.98 68.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.389 -174.212 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.68 ' HG2' ' O ' ' A' ' 46' ' ' LEU . 30.3 mmt180 -64.23 -61.69 2.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.827 0.346 . . . . 0.0 110.313 -177.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.98 -33.37 71.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.808 -177.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.663 ' HD1' HD11 ' A' ' 53' ' ' LEU . 72.4 t80 -54.69 -56.19 21.77 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.707 -0.678 . . . . 0.0 111.605 179.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.663 HD11 ' HD1' ' A' ' 52' ' ' PHE . 9.7 mp -63.66 -39.11 93.51 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.83 -0.348 . . . . 0.0 111.056 -178.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.717 ' HE2' HD11 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -66.77 -38.24 86.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.885 0.374 . . . . 0.0 111.646 -179.572 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.825 ' HZ2' ' HA ' ' A' ' 55' ' ' LYS . 0.8 OUTLIER -79.87 -30.02 40.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 179.606 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.671 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -70.75 -28.67 64.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.03 0.443 . . . . 0.0 110.599 -176.416 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.584 ' O ' ' HG ' ' A' ' 28' ' ' LEU . . . 128.86 64.78 0.11 Allowed Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.213 177.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.537 HD11 HD11 ' A' ' 28' ' ' LEU . 15.2 tp -160.6 155.65 24.44 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 -178.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.565 ' O ' HG21 ' A' ' 63' ' ' ILE . 4.5 p -95.4 163.34 13.28 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.771 ' O ' HG12 ' A' ' 63' ' ' ILE . 4.9 m-20 -55.66 -37.99 68.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.679 0.276 . . . . 0.0 111.33 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -52.52 -52.13 56.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.95 0.405 . . . . 0.0 111.514 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.422 ' HB2' ' HG ' ' A' ' 58' ' ' LEU . 8.8 mp0 -72.49 -25.34 61.38 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.423 -176.086 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.771 HG12 ' O ' ' A' ' 60' ' ' ASP . 8.1 pt -64.12 -38.85 83.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 C-N-CA 119.695 -0.802 . . . . 0.0 110.718 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.11 -30.84 63.93 Favored 'General case' 0 C--O 1.206 -1.204 0 C-N-CA 119.361 -0.936 . . . . 0.0 109.001 173.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.786 ' HA ' ' HE2' ' A' ' 65' ' ' MET . 2.4 tpt -59.01 -45.17 91.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.088 0.471 . . . . 0.0 109.967 177.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.31 -48.96 54.26 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.147 177.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.462 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.3 m-85 -65.73 -32.35 73.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.841 -178.075 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -67.93 -44.53 76.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.441 0.639 . . . . 0.0 109.548 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -70.95 -28.83 64.77 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.668 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.9 t -73.15 -15.23 61.47 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.571 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.96 -4.65 75.24 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.09 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 18.4 p . . . . . 0 C--N 1.325 -0.458 0 CA-C-O 121.364 0.602 . . . . 0.0 111.197 -177.957 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? . . . . . 0 CA--C 1.531 0.215 0 CA-C-O 120.954 0.407 . . . . 0.0 110.723 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 105' ' ' PHE . . . . . 0.449 ' O ' ' HE1' ' A' ' 35' ' ' PHE . 82.5 t80 -66.4 -27.66 68.02 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.785 -178.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 106' ' ' PHE . . . . . 0.575 ' HB3' ' CE2' ' A' ' 52' ' ' PHE . 65.1 m-85 -88.97 -33.99 17.02 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.95 0.405 . . . . 0.0 111.332 -177.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -89.45 -43.9 10.53 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -173.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -68.98 -44.75 72.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.787 0.327 . . . . 0.0 111.061 -175.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . 0.579 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 8.8 mp -72.65 -4.57 31.84 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.474 -176.43 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 110' ' ' PHE . . . . . 0.483 ' CE1' ' HG2' ' A' ' 56' ' ' LYS . 4.5 t80 -104.68 -4.09 22.88 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.926 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -61.58 -64.3 0.99 Allowed 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.378 -177.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 3.0 p . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.75 -0.643 . . . . 0.0 110.906 -179.644 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo . . . . . 0 C--O 1.235 0.352 0 CA-C-O 121.068 0.362 . . . . 0.0 112.911 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.577 ' HB2' HD22 ' A' ' 28' ' ' LEU . 61.6 mtp180 -137.19 128.75 28.51 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.495 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.629 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 32.0 mt-10 -56.92 -35.75 39.06 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -176.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.629 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 4.3 Cg_endo -49.64 -29.76 20.25 Favored 'Trans proline' 0 C--N 1.358 1.079 0 C-N-CA 122.197 1.931 . . . . 0.0 112.996 172.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.577 HD22 ' HB2' ' A' ' 25' ' ' ARG . 4.3 mm? -66.08 -30.97 71.57 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.758 0.313 . . . . 0.0 110.764 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.412 ' O ' HG22 ' A' ' 33' ' ' VAL . 44.9 mm -62.39 -42.95 97.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.868 177.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.3 -46.27 84.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.15 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.6 m -61.73 -41.73 98.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.934 0.397 . . . . 0.0 110.483 177.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.537 ' O ' HD12 ' A' ' 36' ' ' LEU . . . -63.59 -45.3 91.01 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.77 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.412 HG22 ' O ' ' A' ' 29' ' ' ILE . 72.3 t -63.88 -39.97 87.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.664 0.269 . . . . 0.0 110.764 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.431 ' HE2' ' O ' ' B' ' 109' ' ' LEU . 0.8 OUTLIER -55.83 -50.5 70.37 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.199 0.524 . . . . 0.0 110.219 174.754 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.421 ' N ' ' HD3' ' A' ' 34' ' ' LYS . 84.4 t80 -59.82 -56.25 24.06 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.638 178.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.537 HD12 ' O ' ' A' ' 32' ' ' ALA . 1.8 mp -50.78 -57.74 7.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.985 -1.007 . . . . 0.0 112.565 -177.088 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.406 ' HG2' ' HD3' ' A' ' 42' ' ' ARG . 35.3 mt-30 -95.28 32.64 1.7 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.641 -171.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -70.1 -63.08 1.15 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 173.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.8 p -167.57 -68.17 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.513 -178.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -96.62 -15.25 21.63 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -171.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.456 ' HB ' ' O ' ' A' ' 36' ' ' LEU . 85.6 t -59.78 -43.44 91.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 112.81 0.671 . . . . 0.0 112.81 -171.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.406 ' HD3' ' HG2' ' A' ' 37' ' ' GLN . 60.1 mtm180 -68.07 -19.03 64.83 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.126 -178.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -92.86 -15.92 25.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.253 0.549 . . . . 0.0 110.456 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 31.0 m -72.24 152.41 92.36 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.119 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -43.31 124.99 4.26 Favored 'Trans proline' 0 C--O 1.237 0.44 0 C-N-CA 123.731 2.954 . . . . 0.0 113.012 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.617 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 5.7 mp -69.28 -33.06 72.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.284 -178.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -55.76 -43.93 77.18 Favored 'General case' 0 C--O 1.234 0.24 0 O-C-N 123.444 0.465 . . . . 0.0 110.632 176.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.501 HG22 ' CZ ' ' B' ' 106' ' ' PHE . 99.9 m -55.97 -52.41 64.27 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.146 173.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.701 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 61.6 mtm180 -65.28 -21.49 66.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.487 -175.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.617 ' HG2' ' O ' ' A' ' 46' ' ' LEU . 32.5 mmt180 -66.56 -61.0 2.21 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 175.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.87 -42.94 94.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.022 177.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.677 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 80.2 t80 -49.48 -61.08 2.3 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.985 178.002 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.771 ' HG ' HG13 ' A' ' 63' ' ' ILE . 2.8 mm? -53.12 -42.63 66.21 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -177.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.464 ' HD3' ' O ' ' A' ' 50' ' ' ARG . 1.7 mptm? -67.46 -36.82 81.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.858 0.361 . . . . 0.0 111.136 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -78.2 -23.51 47.5 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.143 -0.481 . . . . 0.0 112.078 -177.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.677 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 19.7 mmmt -79.64 -29.11 40.9 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.922 -178.062 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 128.39 37.98 0.39 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.84 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.7 mp -130.12 132.45 46.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.829 0.347 . . . . 0.0 110.35 177.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 20.8 p -79.03 176.94 9.19 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.604 176.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.48 ' HA ' HG23 ' A' ' 63' ' ' ILE . 8.4 m-20 -59.59 -38.53 81.45 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 -174.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.416 ' HG3' ' HG3' ' A' ' 62' ' ' GLU . 8.5 pt-20 -65.42 -33.33 75.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.262 0.553 . . . . 0.0 110.792 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.416 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 45.3 mt-10 -79.87 -37.03 35.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.627 -176.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.771 HG13 ' HG ' ' A' ' 53' ' ' LEU . 4.6 tt -64.08 -42.74 96.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.953 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.669 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 4.2 p30 -77.98 -19.43 54.5 Favored 'General case' 0 C--O 1.205 -1.274 0 C-N-CA 118.684 -1.207 . . . . 0.0 110.649 174.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.912 ' HE1' ' HA ' ' A' ' 65' ' ' MET . 0.5 OUTLIER -61.91 -47.33 85.43 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.674 173.935 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.94 -41.12 64.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.921 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.701 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.1 m-85 -73.03 -31.64 64.57 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -178.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.669 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 4.2 tp-100 -67.0 -47.81 70.36 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -70.32 -31.27 68.51 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.755 -177.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.407 ' HG ' ' HA ' ' A' ' 67' ' ' PHE . 12.5 p -73.86 -9.14 58.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.747 0.308 . . . . 0.0 111.269 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 84.46 27.27 36.48 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.917 -0.659 . . . . 0.0 113.404 173.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 69.7 p . . . . . 0 C--N 1.323 -0.548 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 177.842 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 61.0 tttm . . . . . 0 CA--C 1.529 0.158 0 CA-C-O 121.06 0.457 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -73.07 -34.91 66.53 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.443 -179.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 106' ' ' PHE . . . . . 0.501 ' CZ ' HG22 ' A' ' 48' ' ' THR . 24.7 m-85 -80.37 -20.73 43.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.762 -175.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -98.16 -62.73 1.2 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.701 0.286 . . . . 0.0 111.375 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -64.38 -36.02 82.79 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -170.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . 0.431 ' O ' ' HE2' ' A' ' 34' ' ' LYS . 0.5 OUTLIER -79.99 -4.85 54.3 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.872 0.367 . . . . 0.0 110.887 -173.93 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 110' ' ' PHE . . . . . 0.553 ' CE1' ' HB3' ' A' ' 56' ' ' LYS . 12.9 t80 -100.34 -4.66 28.71 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.847 0.356 . . . . 0.0 110.721 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -56.68 -52.15 66.03 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.861 -178.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 7.4 t . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.121 -0.942 . . . . 0.0 109.221 -178.804 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo . . . . . 0 C--O 1.233 0.225 0 CA-C-O 121.373 0.489 . . . . 0.0 111.711 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.404 HH21 HD21 ' A' ' 28' ' ' LEU . 88.4 mtm180 -105.06 133.72 49.37 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.621 -176.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.533 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 38.8 mt-10 -65.34 -45.21 70.11 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.078 -0.965 . . . . 0.0 112.297 -177.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.533 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 19.5 Cg_endo -62.69 -22.97 74.46 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 121.923 1.749 . . . . 0.0 112.268 175.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.427 ' O ' ' HB ' ' A' ' 31' ' ' THR . 38.8 tp -71.71 -33.11 68.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.9 178.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.513 ' O ' HG21 ' A' ' 33' ' ' VAL . 66.1 mt -62.19 -45.43 98.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 174.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.63 -29.37 70.62 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.651 177.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.427 ' HB ' ' O ' ' A' ' 28' ' ' LEU . 55.3 m -66.6 -43.55 84.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.464 174.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.549 ' O ' HD12 ' A' ' 36' ' ' LEU . . . -62.41 -44.57 96.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.578 178.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.513 HG21 ' O ' ' A' ' 29' ' ' ILE . 40.3 t -61.46 -43.66 97.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.321 178.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.413 ' HD2' ' N ' ' A' ' 35' ' ' PHE . 3.3 tmmm? -53.27 -51.4 62.39 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.333 0.587 . . . . 0.0 110.359 174.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.437 ' CD2' HG12 ' A' ' 41' ' ' VAL . 85.4 t80 -55.76 -52.12 65.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.422 178.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.577 HD23 ' CD1' ' A' ' 67' ' ' PHE . 5.4 mp -58.01 -51.72 68.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.188 -0.915 . . . . 0.0 113.159 -176.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -79.93 34.54 0.29 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -167.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -100.79 29.26 4.64 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 168.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.0 m 72.31 -65.85 0.33 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 114.624 -1.171 . . . . 0.0 112.078 176.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.8 mtp180 -57.0 -44.27 82.58 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -175.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.437 HG12 ' CD2' ' A' ' 35' ' ' PHE . 47.3 t -62.0 -39.29 83.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.844 -174.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.404 ' HG3' ' O ' ' A' ' 36' ' ' LEU . 55.7 mtm180 -70.37 -13.01 61.96 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.932 -178.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.2 mm-40 -115.59 8.74 15.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.36 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 97.5 p -87.39 154.92 54.34 Favored Pre-proline 0 C--N 1.329 -0.294 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -49.18 116.58 2.31 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.869 2.38 . . . . 0.0 113.027 -178.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.487 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 23.2 mt -58.14 -27.9 64.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.343 177.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.82 -42.45 71.91 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.94 0.4 . . . . 0.0 110.812 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 99.7 m -70.41 -49.82 44.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.216 175.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.823 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 61.0 mtm180 -62.23 -26.42 68.36 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.514 -173.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.554 ' NH1' HD13 ' A' ' 63' ' ' ILE . 22.6 mmm180 -61.21 -61.96 2.19 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.932 0.396 . . . . 0.0 110.61 176.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.71 -32.2 73.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.201 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.658 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 91.6 t80 -54.93 -55.81 26.53 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.862 177.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.899 HD11 ' HB ' ' A' ' 63' ' ' ILE . 19.6 mt -59.55 -44.67 93.17 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.077 0.236 . . . . 0.0 111.026 -177.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 1.115 ' HE2' HD12 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -58.51 -44.44 89.47 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.94 0.4 . . . . 0.0 111.032 -179.577 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 55' ' ' LYS . 31.4 mmtp -70.35 -21.38 62.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.584 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.909 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -73.29 -21.63 60.55 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 121.07 -0.252 . . . . 0.0 111.109 179.07 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.05 32.67 1.49 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.399 -0.905 . . . . 0.0 114.211 173.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.747 HD13 ' HB3' ' A' ' 53' ' ' LEU . 1.4 pp -139.37 142.53 37.55 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 117.479 0.639 . . . . 0.0 110.711 175.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.421 ' O ' HG22 ' A' ' 63' ' ' ILE . 1.1 p -70.19 161.89 29.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.828 -0.624 . . . . 0.0 112.524 -172.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.576 ' O ' HG12 ' A' ' 63' ' ' ILE . 6.3 t70 -50.04 -49.13 52.11 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.093 0.557 . . . . 0.0 111.57 -174.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.485 ' HG3' ' HG2' ' A' ' 62' ' ' GLU . 9.4 pt-20 -53.01 -38.69 62.55 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.677 178.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.485 ' HG2' ' HG3' ' A' ' 61' ' ' GLU . 4.7 mm-40 -78.41 -26.51 46.44 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.752 -175.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 1.115 HD12 ' HE2' ' A' ' 54' ' ' LYS . 1.7 pt -67.4 -38.66 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.872 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.65 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 0.3 OUTLIER -75.33 -27.99 59.46 Favored 'General case' 0 C--O 1.212 -0.871 0 C-N-CA 119.801 -0.76 . . . . 0.0 109.246 177.539 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.808 ' HA ' ' HE2' ' A' ' 65' ' ' MET . 2.0 tpt -61.26 -48.49 81.17 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 176.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.62 -47.22 73.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.911 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.823 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 1.4 m-85 -64.62 -37.46 87.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.593 -179.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.65 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 0.5 OUTLIER -60.62 -53.92 51.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.749 0.785 . . . . 0.0 109.237 177.427 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -62.35 -35.09 78.05 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 113.982 -1.463 . . . . 0.0 111.805 -175.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 24.2 m -82.15 -5.33 58.38 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -176.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.74 61.48 6.16 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.054 -0.593 . . . . 0.0 111.777 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 39.9 p . . . . . 0 C--N 1.323 -0.555 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -172.454 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 34.6 mttp . . . . . 0 CA--C 1.52 -0.202 0 CA-C-O 121.013 0.435 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -76.54 -22.26 54.6 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 120.739 -0.385 . . . . 0.0 111.053 -178.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 106' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -96.55 -32.1 12.43 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 119.798 -0.761 . . . . 0.0 111.477 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -98.36 -48.77 4.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.88 0.372 . . . . 0.0 111.859 -177.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -80.88 -32.0 35.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.445 -172.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . 0.416 ' O ' HD11 ' B' ' 109' ' ' LEU . 1.9 tm? -58.77 -31.53 68.46 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.133 0.492 . . . . 0.0 109.855 179.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 110' ' ' PHE . . . . . 0.536 ' CD1' ' HD3' ' A' ' 56' ' ' LYS . 53.5 t80 -64.81 -53.91 39.4 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.829 -178.467 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -50.08 -65.77 0.51 Allowed 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.414 0.446 . . . . 0.0 111.707 -173.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 26.8 m . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.852 -0.594 . . . . 0.0 110.511 -178.658 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo . . . . . 0 C--O 1.234 0.285 0 CA-C-O 121.308 0.461 . . . . 0.0 111.824 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.451 ' O ' HG13 ' A' ' 29' ' ' ILE . 99.2 mtt180 -127.35 165.17 20.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.836 -176.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.632 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 44.0 mt-10 -75.94 -42.07 3.51 Favored Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -175.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.632 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 4.9 Cg_endo -48.31 -43.93 30.65 Favored 'Trans proline' 0 C--N 1.358 1.058 0 C-N-CA 122.734 2.289 . . . . 0.0 113.513 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.553 HD13 ' N ' ' A' ' 29' ' ' ILE . 2.3 pp -77.05 -25.96 53.07 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.529 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.553 ' N ' HD13 ' A' ' 28' ' ' LEU . 82.9 mt -65.84 -49.07 79.62 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 N-CA-C 109.389 -0.596 . . . . 0.0 109.389 174.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.44 -40.08 81.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.508 177.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 34.5 m -64.85 -40.78 95.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.612 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.426 ' O ' HD21 ' A' ' 36' ' ' LEU . . . -67.0 -39.36 87.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.242 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.453 HG22 ' O ' ' A' ' 29' ' ' ILE . 90.8 t -62.58 -49.12 85.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.693 -0.231 . . . . 0.0 110.878 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.522 ' HD2' ' N ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -67.71 -32.75 73.6 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.028 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.542 ' CE2' HG12 ' A' ' 41' ' ' VAL . 89.7 t80 -59.15 -53.35 59.3 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.078 177.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.707 HD11 HG13 ' A' ' 41' ' ' VAL . 3.4 mm? -58.79 -49.05 79.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.277 -178.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -92.17 6.89 44.95 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -172.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.407 ' HB2' ' O ' ' A' ' 34' ' ' LYS . 5.0 t30 -60.67 -45.73 93.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.639 0.257 . . . . 0.0 110.778 -177.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.582 ' HB2' ' HZ ' ' B' ' 105' ' ' PHE . 14.7 m -156.5 -67.05 0.11 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.865 0.365 . . . . 0.0 111.294 -176.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.45 ' HA ' ' NE2' ' A' ' 43' ' ' GLN . 5.3 ptp180 -132.46 -8.83 3.28 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -170.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.707 HG13 HD11 ' A' ' 36' ' ' LEU . 58.3 t -57.51 -40.27 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -172.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.744 ' HG3' HG21 ' A' ' 72' ' ' THR . 33.8 ttp180 -66.08 -21.0 66.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.834 0.349 . . . . 0.0 110.326 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.45 ' NE2' ' HA ' ' A' ' 40' ' ' ARG . 0.5 OUTLIER -97.74 -5.46 34.99 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.488 176.332 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.2 m -83.06 156.59 66.87 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.021 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -45.47 126.2 8.28 Favored 'Trans proline' 0 C--O 1.241 0.645 0 C-N-CA 123.8 3.0 . . . . 0.0 113.665 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.638 ' HG ' ' NH2' ' A' ' 49' ' ' ARG . 6.1 mp -66.66 -24.13 66.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.556 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.46 -44.68 85.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.665 176.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 84.8 m -64.6 -50.34 67.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.318 176.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.708 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 15.6 mtm180 -65.4 -31.36 72.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.215 -172.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.1 mtt-85 -66.4 -52.54 45.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.708 0.29 . . . . 0.0 111.045 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.7 -40.18 96.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.052 0.453 . . . . 0.0 109.958 176.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.808 ' HD1' HD13 ' A' ' 53' ' ' LEU . 77.0 t80 -51.73 -68.56 0.16 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.961 -1.018 . . . . 0.0 111.376 177.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.808 HD13 ' HD1' ' A' ' 52' ' ' PHE . 9.8 mp -57.1 -36.22 70.35 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -175.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.45 -36.12 81.99 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.901 178.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -77.26 -23.66 51.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.872 0.368 . . . . 0.0 111.302 176.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.671 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 19.8 mmmt -77.28 -14.5 59.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.522 -178.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 116.0 22.81 4.46 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.58 -0.819 . . . . 0.0 113.179 176.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.495 ' HG ' HD11 ' A' ' 28' ' ' LEU . 5.7 mp -108.13 140.77 40.83 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.933 0.367 . . . . 0.0 110.739 177.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.8 p -84.43 174.02 10.41 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.834 172.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.589 ' HA ' HG23 ' A' ' 63' ' ' ILE . 0.4 OUTLIER -59.97 -40.89 90.61 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 -178.726 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -59.91 -40.34 88.52 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.289 0.566 . . . . 0.0 110.551 177.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -79.37 -28.04 41.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.146 -174.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.67 HG13 HD23 ' A' ' 53' ' ' LEU . 9.9 tt -69.53 -40.01 79.14 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.778 -178.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.619 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 0.4 OUTLIER -67.73 -40.52 84.19 Favored 'General case' 0 C--O 1.207 -1.149 0 C-N-CA 119.034 -1.066 . . . . 0.0 108.254 174.701 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.864 ' HE1' ' HA ' ' A' ' 65' ' ' MET . 1.4 tpt -56.11 -42.77 77.36 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 120.958 0.409 . . . . 0.0 111.134 -177.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.44 -44.64 70.87 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.975 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.708 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.6 m-85 -69.43 -29.32 67.01 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.619 ' HG2' ' O ' ' A' ' 64' ' ' ASP . 69.6 mm-40 -62.88 -52.7 62.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.306 0.574 . . . . 0.0 109.757 178.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -67.92 -28.55 67.59 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.921 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.1 t -75.47 -10.01 59.07 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.203 0.525 . . . . 0.0 111.408 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 67.88 43.31 83.67 Favored Glycine 0 N--CA 1.451 -0.357 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.597 176.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.744 HG21 ' HG3' ' A' ' 42' ' ' ARG . 22.0 p . . . . . 0 C--N 1.323 -0.564 0 CA-C-O 120.535 0.207 . . . . 0.0 110.745 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . 0.405 ' HE2' ' HB3' ' B' ' 104' ' ' LYS . 46.9 mtpt . . . . . 0 C--O 1.227 -0.103 0 N-CA-C 111.536 0.199 . . . . 0.0 111.536 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 105' ' ' PHE . . . . . 0.582 ' HZ ' ' HB2' ' A' ' 39' ' ' SER . 39.0 t80 -68.21 -27.47 66.41 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.801 0.334 . . . . 0.0 110.237 -178.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 106' ' ' PHE . . . . . 0.453 ' CD2' ' HZ ' ' A' ' 35' ' ' PHE . 60.6 m-85 -87.61 -23.73 24.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.162 0.506 . . . . 0.0 110.812 176.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -93.46 -64.78 1.05 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.589 -174.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -64.64 -22.04 66.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.61 -170.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . 0.511 HD12 ' HA ' ' B' ' 105' ' ' PHE . 10.6 mp -82.72 -10.74 58.77 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.896 -0.322 . . . . 0.0 111.523 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 110' ' ' PHE . . . . . 0.536 ' CE1' ' HB3' ' A' ' 56' ' ' LYS . 2.7 t80 -101.39 -11.88 19.04 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 119.497 -0.881 . . . . 0.0 110.841 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -71.85 -71.93 0.25 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 173.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 52.0 m . . . . . 0 C--O 1.247 0.951 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.651 172.86 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.529 ' HA ' ' OE2' ' A' ' 62' ' ' GLU . 14.4 Cg_exo . . . . . 0 C--O 1.236 0.38 0 CA-C-O 120.788 0.245 . . . . 0.0 112.209 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -143.12 123.86 14.17 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.468 -178.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.647 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 0.5 OUTLIER -67.01 -40.7 30.87 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.374 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.647 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 9.4 Cg_endo -53.22 -35.63 74.49 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 122.145 1.897 . . . . 0.0 112.414 175.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.472 HD21 ' HB2' ' A' ' 58' ' ' LEU . 4.3 tt -76.13 -28.87 57.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.896 0.379 . . . . 0.0 110.027 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.494 HG12 HD12 ' A' ' 58' ' ' LEU . 70.7 mt -60.03 -41.84 87.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 172.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.71 -40.06 95.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.548 176.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.1 m -58.97 -41.07 86.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.3 0.571 . . . . 0.0 110.199 175.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.582 ' O ' HD12 ' A' ' 36' ' ' LEU . . . -67.4 -45.12 77.09 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.076 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.443 HG22 ' O ' ' A' ' 29' ' ' ILE . 73.8 t -62.12 -45.26 99.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -177.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.62 -29.06 69.0 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.108 0.48 . . . . 0.0 110.237 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.467 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 79.9 t80 -66.19 -57.94 6.51 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.414 -0.812 . . . . 0.0 108.995 173.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.582 HD12 ' O ' ' A' ' 32' ' ' ALA . 1.2 mp -50.49 -56.86 9.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.541 -1.209 . . . . 0.0 112.127 -178.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.509 ' HG2' ' HD3' ' A' ' 42' ' ' ARG . 45.9 mt-30 -83.8 34.38 0.49 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -173.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -93.0 25.68 3.12 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 166.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.1 t 73.32 -64.15 0.41 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-N 114.767 -1.106 . . . . 0.0 111.724 178.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -65.53 -23.03 66.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.009 -172.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.483 ' HB ' ' O ' ' A' ' 36' ' ' LEU . 51.8 t -80.57 -37.74 17.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.245 -179.297 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.509 ' HD3' ' HG2' ' A' ' 37' ' ' GLN . 25.8 mtm180 -66.23 -22.7 66.34 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.225 -0.59 . . . . 0.0 109.689 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -99.46 9.92 42.36 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.761 174.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 28.0 t -91.53 142.41 26.84 Favored Pre-proline 0 C--N 1.326 -0.441 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 176.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.403 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 9.6 Cg_endo -49.91 128.39 21.71 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 123.547 2.832 . . . . 0.0 112.695 -178.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.523 ' O ' ' HG3' ' A' ' 50' ' ' ARG . 7.5 mp -60.93 -30.13 70.03 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.753 -178.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -51.23 -46.53 62.3 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 123.638 0.586 . . . . 0.0 110.787 176.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.489 HG22 ' CZ ' ' B' ' 106' ' ' PHE . 98.4 m -70.51 -53.31 16.71 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.358 176.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.482 ' NH2' ' HG ' ' A' ' 46' ' ' LEU . 16.7 mtm180 -55.39 -44.89 76.54 Favored 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.646 0.591 . . . . 0.0 112.235 -171.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.557 ' O ' ' HD3' ' A' ' 54' ' ' LYS . 67.1 mtm180 -63.16 -54.86 31.09 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.85 -176.049 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.484 ' O ' ' HG2' ' A' ' 55' ' ' LYS . . . -60.48 -43.46 96.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.953 0.406 . . . . 0.0 110.357 178.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.658 ' HD1' HD11 ' A' ' 53' ' ' LEU . 72.2 t80 -49.6 -57.6 6.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.727 178.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.658 HD11 ' HD1' ' A' ' 52' ' ' PHE . 8.6 mp -57.67 -43.99 85.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.717 -0.22 . . . . 0.0 111.38 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.824 ' HE3' HD11 ' A' ' 63' ' ' ILE . 2.2 mptm? -61.64 -46.68 88.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.777 0.322 . . . . 0.0 110.983 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 51' ' ' ALA . 14.5 mmmm -72.23 -23.87 61.3 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.9 -173.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.754 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 10.3 mmpt? -74.59 -19.2 60.41 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.767 0.317 . . . . 0.0 110.413 177.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.25 51.68 0.35 Allowed Glycine 0 N--CA 1.444 -0.776 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.444 177.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.556 HD21 HG21 ' A' ' 63' ' ' ILE . 22.8 tp -142.19 141.32 32.57 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -179.222 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.531 ' O ' HG22 ' A' ' 63' ' ' ILE . 1.2 m -76.18 157.02 33.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.713 -178.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.737 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 23.0 p-10 -60.75 -45.87 92.65 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -178.148 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.627 ' HG3' ' HG3' ' A' ' 62' ' ' GLU . 7.3 pt-20 -52.61 -37.52 58.46 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.699 0.762 . . . . 0.0 111.104 177.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.627 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 47.5 mt-10 -78.91 -27.3 43.78 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.915 -174.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.824 HD11 ' HE3' ' A' ' 54' ' ' LYS . 3.7 pt -70.51 -34.6 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.177 177.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.504 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 0.6 OUTLIER -68.44 -31.79 71.36 Favored 'General case' 0 C--O 1.209 -1.066 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 176.304 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 37.9 tpp -66.97 -42.68 84.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.843 0.354 . . . . 0.0 110.324 177.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.91 -47.46 83.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.151 176.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.475 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 6.9 m-85 -66.49 -31.68 72.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.0 177.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.504 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 0.9 OUTLIER -65.06 -49.74 68.89 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.314 0.578 . . . . 0.0 109.601 -179.278 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -67.22 -30.88 70.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.048 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 32.4 m -83.37 7.74 15.75 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.492 -178.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 61.38 36.89 93.19 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 116.12 -0.491 . . . . 0.0 112.357 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.9 p . . . . . 0 C--N 1.323 -0.583 0 CA-C-O 121.036 0.446 . . . . 0.0 111.341 -175.019 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 89.1 tttt . . . . . 0 C--O 1.224 -0.258 0 CA-C-O 120.489 0.185 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -75.85 -17.38 59.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.8 0.333 . . . . 0.0 110.216 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 106' ' ' PHE . . . . . 0.559 ' HB3' ' CE2' ' A' ' 52' ' ' PHE . 56.4 m-85 -95.22 -18.61 20.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.4 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -97.8 -62.86 1.19 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.144 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -57.24 -48.02 79.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.18 0.514 . . . . 0.0 110.691 -175.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . 0.488 ' O ' HD11 ' B' ' 109' ' ' LEU . 0.5 OUTLIER -70.91 -22.67 62.22 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.65 -176.089 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 110' ' ' PHE . . . . . 0.44 ' HE2' ' HA ' ' A' ' 32' ' ' ALA . 51.1 t80 -93.08 -43.33 8.93 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.078 -178.001 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -57.24 -43.47 82.96 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.26 -176.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 C--O 1.245 0.837 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.143 176.011 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.699 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 52.4 Cg_exo . . . . . 0 C--O 1.234 0.31 0 CA-C-O 120.837 0.266 . . . . 0.0 112.599 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -128.42 95.95 4.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.632 -176.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.602 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 34.6 tt0 -56.32 -42.99 99.02 Favored Pre-proline 0 CA--C 1.541 0.616 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.602 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 9.0 Cg_endo -52.63 -30.08 44.02 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 122.033 1.822 . . . . 0.0 112.537 176.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.666 HD21 HD11 ' A' ' 58' ' ' LEU . 7.1 tt -71.17 -22.0 62.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.416 -178.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.657 HD13 ' HB3' ' A' ' 62' ' ' GLU . 47.4 mm -58.74 -46.53 90.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.723 0.297 . . . . 0.0 110.349 176.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.12 -44.59 95.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.103 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 34.7 m -57.44 -38.3 74.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.723 176.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.778 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -68.99 -48.81 62.19 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.389 -179.027 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.41 HG22 ' O ' ' A' ' 29' ' ' ILE . 89.1 t -59.47 -45.57 93.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 111.422 0.156 . . . . 0.0 111.422 -177.647 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.569 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 0.0 OUTLIER -69.27 -23.74 63.88 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.888 0.375 . . . . 0.0 110.584 179.404 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.53 ' HZ ' ' CD2' ' B' ' 106' ' ' PHE . 86.5 t80 -70.48 -54.66 11.38 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.389 -0.596 . . . . 0.0 109.389 174.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.778 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 33.3 mt -57.01 -55.52 33.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.427 -176.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -95.17 28.11 2.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.137 -175.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 34' ' ' LYS . 15.5 t-20 -68.84 -50.6 48.6 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 173.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.4 p -173.49 -68.08 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.414 176.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 55.8 mtp180 -95.41 -20.22 19.27 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -169.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.523 HG21 ' HE2' ' B' ' 105' ' ' PHE . 48.9 t -63.86 -34.97 71.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 CA-C-N 118.022 0.374 . . . . 0.0 111.498 -174.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.6 mmm180 -58.3 -29.85 66.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.882 0.373 . . . . 0.0 110.769 174.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -99.02 -5.19 30.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.521 -177.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 51.0 m -80.93 146.77 60.15 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.229 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.19 134.24 49.82 Favored 'Trans proline' 0 C--O 1.239 0.528 0 C-N-CA 123.023 2.482 . . . . 0.0 112.794 -178.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.465 ' O ' ' HG3' ' A' ' 50' ' ' ARG . 7.8 mp -64.07 -28.02 69.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.35 -175.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.17 -50.87 71.49 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.366 0.416 . . . . 0.0 110.528 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 98.9 m -57.42 -56.12 25.9 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.809 174.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.62 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 30.7 mtm180 -56.13 -43.49 78.24 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -170.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.465 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 66.4 mtm180 -69.24 -48.48 61.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.591 0.234 . . . . 0.0 111.441 -174.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.462 ' O ' ' HG3' ' A' ' 55' ' ' LYS . . . -64.83 -38.29 90.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.258 0.551 . . . . 0.0 109.787 177.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.607 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 55.3 t80 -48.96 -67.56 0.26 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.735 -1.12 . . . . 0.0 112.393 179.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 49' ' ' ARG . 0.4 OUTLIER -68.11 -29.98 69.03 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -174.523 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.841 ' HE2' HD12 ' A' ' 63' ' ' ILE . 59.0 mttm -59.14 -42.12 89.92 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.112 0.482 . . . . 0.0 110.224 173.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.462 ' HG3' ' O ' ' A' ' 51' ' ' ALA . 28.8 mtpp -74.94 -30.64 61.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.395 -178.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 11.4 mmpt? -64.42 -27.13 68.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.356 0.598 . . . . 0.0 109.966 176.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 127.57 65.92 0.14 Allowed Glycine 0 N--CA 1.443 -0.881 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.182 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.69 ' HG ' ' HB2' ' A' ' 62' ' ' GLU . 11.8 tp -151.23 144.51 24.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.002 0.43 . . . . 0.0 110.511 -178.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.562 ' O ' HG22 ' A' ' 63' ' ' ILE . 2.7 m -87.94 166.51 14.46 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.97 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.56 ' O ' HG12 ' A' ' 63' ' ' ILE . 4.6 m-20 -50.77 -57.7 7.72 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 122.88 0.472 . . . . 0.0 111.779 178.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.425 ' HA ' ' OD2' ' A' ' 64' ' ' ASP . 7.7 pt-20 -58.52 -27.63 64.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.756 -177.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.699 ' OE1' ' HA ' ' A' ' 24' ' ' PRO . 51.8 mt-10 -79.9 -28.17 39.86 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.854 -178.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.841 HD12 ' HE2' ' A' ' 54' ' ' LYS . 3.2 pt -70.11 -34.15 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 C-N-CA 119.952 -0.699 . . . . 0.0 109.758 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.425 ' OD2' ' HA ' ' A' ' 61' ' ' GLU . 3.0 p30 -77.3 -26.02 51.88 Favored 'General case' 0 C--O 1.21 -0.996 0 C-N-CA 119.532 -0.867 . . . . 0.0 110.223 173.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.857 ' HA ' ' HE2' ' A' ' 65' ' ' MET . 0.3 OUTLIER -56.69 -50.94 70.65 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 119.599 -0.84 . . . . 0.0 108.786 173.318 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.42 -57.68 6.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.456 178.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.62 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 3.6 m-85 -66.13 -38.49 88.28 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -173.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -65.68 -45.75 81.68 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -178.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -77.24 -21.26 54.02 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.258 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 32.5 t -79.6 -14.9 58.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.67 0.271 . . . . 0.0 110.37 176.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 80.37 28.37 48.61 Favored Glycine 0 C--N 1.333 0.368 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.78 176.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.611 HG21 ' HD1' ' A' ' 67' ' ' PHE . 10.2 t . . . . . 0 C--N 1.325 -0.487 0 CA-C-O 122.107 0.956 . . . . 0.0 110.467 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . 0.454 ' HZ3' ' CD ' ' B' ' 108' ' ' GLU . 59.8 tttp . . . . . 0 N--CA 1.462 0.13 0 CA-C-O 121.136 0.493 . . . . 0.0 110.155 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 105' ' ' PHE . . . . . 0.523 ' HE2' HG21 ' A' ' 41' ' ' VAL . 33.4 t80 -69.57 -42.3 74.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.66 -177.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 106' ' ' PHE . . . . . 0.53 ' CD2' ' HZ ' ' A' ' 35' ' ' PHE . 37.8 m-85 -75.92 -38.29 57.85 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -178.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.3 -60.16 2.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.238 -172.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 108' ' ' GLU . . . . . 0.454 ' CD ' ' HZ3' ' B' ' 104' ' ' LYS . 43.5 tt0 -61.09 -49.97 75.17 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -171.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . 0.569 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 72.6 mt -58.5 -33.96 70.4 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.735 0.302 . . . . 0.0 111.429 -176.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 110' ' ' PHE . . . . . 0.683 ' HE2' ' HA ' ' A' ' 32' ' ' ALA . 6.1 t80 -92.02 -5.95 52.01 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.212 -174.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -73.83 -23.68 59.68 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.816 -178.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 112' ' ' SER . . . . . 0.491 ' C ' ' HZ3' ' A' ' 34' ' ' LYS . 48.8 m . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.987 -0.53 . . . . 0.0 109.762 176.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.437 ' HA ' ' O ' ' A' ' 57' ' ' GLY . 21.5 Cg_exo . . . . . 0 N--CA 1.461 -0.413 0 CA-C-O 120.926 0.303 . . . . 0.0 111.878 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 74.4 mtt180 -119.71 160.79 21.87 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.685 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.588 ' HB2' ' HD3' ' A' ' 27' ' ' PRO . 39.4 mt-10 -66.18 -55.05 22.41 Favored Pre-proline 0 CA--C 1.539 0.527 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -174.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.588 ' HD3' ' HB2' ' A' ' 26' ' ' GLU . 86.1 Cg_endo -78.85 -16.87 12.57 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 122.083 1.855 . . . . 0.0 112.72 -175.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.4 tt -65.72 -30.52 71.2 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.239 -175.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.7 mt -64.68 -37.76 80.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.125 0.488 . . . . 0.0 110.082 175.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.411 ' O ' HG11 ' A' ' 33' ' ' VAL . . . -70.81 -39.15 73.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.519 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.6 m -61.13 -39.48 90.2 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 121.024 0.44 . . . . 0.0 110.041 174.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.722 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -66.93 -49.13 66.47 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.436 179.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.411 HG11 ' O ' ' A' ' 30' ' ' ALA . 9.8 p -64.34 -35.22 73.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.615 -178.418 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.526 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.6 tmmm? -59.09 -52.26 66.52 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 172.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.506 ' HZ ' ' CD2' ' B' ' 106' ' ' PHE . 85.9 t80 -50.95 -52.8 38.76 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.571 179.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 39.3 mt -59.63 -40.38 87.44 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.764 -176.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -85.95 32.01 0.61 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -172.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -101.71 28.99 5.18 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.239 0.542 . . . . 0.0 109.683 170.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.3 m 70.56 -66.95 0.26 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 114.711 -1.132 . . . . 0.0 112.339 175.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -57.54 -36.12 71.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.635 -173.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.602 HG13 ' HD3' ' A' ' 49' ' ' ARG . 51.5 t -63.03 -44.62 99.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.406 -176.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.509 ' HD2' ' CG2' ' A' ' 72' ' ' THR . 32.9 mtm180 -67.35 -18.76 65.28 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.007 0.432 . . . . 0.0 110.337 -177.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -96.73 -0.87 47.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.682 178.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.6 m -88.22 153.18 51.17 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.289 175.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -60.97 142.37 97.32 Favored 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 122.547 2.165 . . . . 0.0 112.579 -177.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.4 mt -63.11 -23.58 67.51 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.701 177.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.6 -47.59 73.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.355 174.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 73.7 m -70.49 -59.57 2.77 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.324 174.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.875 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 41.0 mtm180 -52.94 -47.41 68.07 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -171.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.44 ' HG2' ' HE2' ' A' ' 67' ' ' PHE . 80.5 mtm180 -67.38 -52.74 36.39 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 121.156 -0.218 . . . . 0.0 111.46 -174.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.44 -34.68 78.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.148 0.499 . . . . 0.0 110.389 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.615 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 49.8 t80 -54.88 -66.41 0.41 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.143 -0.935 . . . . 0.0 112.339 179.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 49' ' ' ARG . 0.5 OUTLIER -68.07 -23.73 64.98 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.713 -173.809 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.576 ' HA ' ' O ' ' A' ' 58' ' ' LEU . 97.4 mttt -63.15 -48.62 77.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.985 0.421 . . . . 0.0 110.683 173.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -67.85 -22.39 65.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.698 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.615 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 11.4 mmpt? -69.78 -45.38 68.13 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.99 176.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.437 ' O ' ' HA ' ' A' ' 24' ' ' PRO . . . 150.79 62.73 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.206 -0.997 . . . . 0.0 113.724 176.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.576 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 3.0 pp -171.89 148.36 2.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.938 0.399 . . . . 0.0 110.75 173.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.622 HG21 ' H ' ' A' ' 60' ' ' ASP . 1.5 m -93.75 177.05 6.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.02 -177.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.661 ' O ' HG12 ' A' ' 63' ' ' ILE . 2.7 m-20 -49.81 -46.03 50.58 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -174.365 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 65' ' ' MET . 8.6 pt-20 -52.15 -40.29 61.2 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.163 0.506 . . . . 0.0 111.356 178.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.56 ' CB ' ' HB2' ' A' ' 58' ' ' LEU . 1.5 mp0 -77.45 -27.03 52.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.354 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.661 HG12 ' O ' ' A' ' 60' ' ' ASP . 2.4 pt -69.53 -39.62 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 120.269 -0.573 . . . . 0.0 110.158 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.54 -26.8 63.73 Favored 'General case' 0 C--O 1.211 -0.956 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 176.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.902 ' HE3' ' HA ' ' A' ' 65' ' ' MET . 19.0 mmt -64.84 -49.9 68.76 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.227 175.272 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.72 -40.86 84.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.169 0.509 . . . . 0.0 110.365 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.875 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.8 m-85 -69.82 -28.56 65.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.194 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.3 tp60 -65.87 -50.06 65.9 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.037 0.446 . . . . 0.0 110.058 176.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -62.62 -36.94 84.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.888 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 32.4 p -83.86 0.23 48.48 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.572 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.91 37.19 94.28 Favored Glycine 0 C--N 1.334 0.433 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.738 177.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.509 ' CG2' ' HD2' ' A' ' 42' ' ' ARG . 35.9 p . . . . . 0 C--N 1.324 -0.523 0 CA-C-O 121.074 0.464 . . . . 0.0 111.837 -176.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . 0.655 ' HZ1' ' HB2' ' B' ' 104' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.226 -0.145 0 CA-C-O 120.599 0.237 . . . . 0.0 110.894 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -70.78 -35.11 72.42 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.787 0.327 . . . . 0.0 110.228 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 106' ' ' PHE . . . . . 0.506 ' CD2' ' HZ ' ' A' ' 35' ' ' PHE . 12.3 m-85 -79.02 -33.48 44.8 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.526 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 107' ' ' GLN . . . . . 0.573 ' HG2' ' HA ' ' B' ' 104' ' ' LYS . 11.4 pt20 -91.65 -50.15 5.91 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -175.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 108' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' B' ' 107' ' ' GLN . 20.5 tt0 -78.58 -28.69 45.91 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 111.628 0.233 . . . . 0.0 111.628 -169.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . 0.526 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 42.2 tp -69.66 -19.3 63.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.08 0.467 . . . . 0.0 110.161 178.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 110' ' ' PHE . . . . . 0.502 ' CE2' ' HA ' ' A' ' 32' ' ' ALA . 2.3 t80 -97.16 -5.2 37.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.855 -179.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -63.33 -52.48 61.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.385 0.612 . . . . 0.0 109.926 177.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 C--O 1.248 0.981 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.606 179.226 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.518 ' HB3' ' HG2' ' A' ' 62' ' ' GLU . 28.7 Cg_endo . . . . . 0 CA--C 1.527 0.17 0 CA-C-O 121.399 0.499 . . . . 0.0 111.988 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.542 ' HB2' ' HB2' ' A' ' 28' ' ' LEU . 74.6 mtt180 -90.2 147.52 23.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.927 -177.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.46 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 13.2 tp10 -61.97 -53.09 62.99 Favored Pre-proline 0 CA--C 1.539 0.533 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.131 -179.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.46 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 26.8 Cg_endo -64.2 -20.14 66.71 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 121.993 1.796 . . . . 0.0 112.178 178.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.542 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 46.7 tp -67.78 -46.26 72.51 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.838 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 50.7 mm -64.12 -42.05 94.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.168 177.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.42 -43.19 93.1 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.181 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 31.7 m -67.91 -36.56 80.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.617 178.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.498 ' O ' HD12 ' A' ' 36' ' ' LEU . . . -61.7 -40.62 95.65 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.749 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 80.3 t -64.89 -43.21 96.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.807 0.337 . . . . 0.0 110.334 177.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.456 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 5.4 tmtm? -55.87 -45.46 78.51 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.166 174.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.538 ' O ' HG23 ' A' ' 41' ' ' VAL . 78.5 t80 -60.96 -56.92 15.42 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.342 178.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.527 ' HG ' ' HE1' ' A' ' 67' ' ' PHE . 0.6 OUTLIER -51.59 -42.02 61.62 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.342 -176.207 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -92.06 39.62 1.02 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.328 0.585 . . . . 0.0 111.926 -174.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.673 ' HB3' HG22 ' A' ' 41' ' ' VAL . 27.8 t-20 -88.21 6.45 36.67 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 167.165 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.43 ' HB3' ' O ' ' A' ' 38' ' ' ASN . 46.8 t 76.44 -60.74 0.47 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.792 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 77.6 mtt180 -69.15 -16.34 63.62 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -177.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.673 HG22 ' HB3' ' A' ' 38' ' ' ASN . 97.4 t -69.56 -32.41 52.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.854 0.359 . . . . 0.0 111.138 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 66.1 mtp180 -74.57 -33.19 62.63 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.126 177.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -76.75 -32.45 57.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.993 177.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -58.91 132.67 86.86 Favored Pre-proline 0 N--CA 1.45 -0.435 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.454 173.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -43.89 124.69 4.78 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.542 2.828 . . . . 0.0 113.04 -174.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.694 ' HA ' ' CG ' ' A' ' 49' ' ' ARG . 5.9 mp -69.54 -18.85 63.7 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.298 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -52.06 -42.71 63.36 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 168.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.467 HG22 ' CE2' ' B' ' 106' ' ' PHE . 68.5 m -67.91 -41.26 82.94 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.263 173.078 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.694 ' CG ' ' HA ' ' A' ' 46' ' ' LEU . 13.4 mmp_? -53.07 -45.83 68.32 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.49 -176.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.563 ' O ' ' HE3' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -62.3 -57.62 10.69 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.834 -0.346 . . . . 0.0 111.644 -179.153 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.37 -42.63 96.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.125 0.488 . . . . 0.0 110.888 -178.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -59.48 -50.5 73.68 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.267 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.505 HD22 ' O ' ' A' ' 49' ' ' ARG . 1.8 mm? -60.29 -47.15 87.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.96 0.41 . . . . 0.0 110.622 179.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.801 ' HE2' HD12 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -64.87 -35.29 80.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.509 -178.434 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.41 ' HD3' ' HA ' ' A' ' 55' ' ' LYS . 31.8 mmtm -78.3 -23.28 47.21 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.882 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -75.74 -11.07 59.92 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.605 0.241 . . . . 0.0 111.039 -177.843 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 114.06 25.92 3.99 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.123 -1.036 . . . . 0.0 114.108 170.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.625 ' CD1' HG21 ' A' ' 63' ' ' ILE . 2.3 pp -135.87 139.39 43.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 117.396 0.598 . . . . 0.0 110.459 177.524 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.38 173.04 11.45 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.775 -176.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.668 ' O ' HG12 ' A' ' 63' ' ' ILE . 14.0 m-20 -52.06 -47.49 65.1 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -173.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -61.65 -28.5 69.43 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.369 -178.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.518 ' HG2' ' HB3' ' A' ' 24' ' ' PRO . 4.9 mp0 -74.98 -29.66 60.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.743 -0.208 . . . . 0.0 110.762 176.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.801 HD12 ' HE2' ' A' ' 54' ' ' LYS . 1.7 pt -69.96 -42.48 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 120.246 -0.582 . . . . 0.0 109.47 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.522 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 9.8 m-20 -73.56 -16.13 61.27 Favored 'General case' 0 C--O 1.211 -0.963 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 177.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.401 ' O ' ' HB3' ' A' ' 68' ' ' GLN . 32.4 tpp -73.04 -50.29 23.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.888 0.375 . . . . 0.0 110.441 173.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.06 -39.47 90.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.308 0.575 . . . . 0.0 109.937 178.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.527 ' HE1' ' HG ' ' A' ' 36' ' ' LEU . 10.3 m-85 -72.91 -27.76 62.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.925 176.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.522 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 22.3 tt0 -60.2 -54.65 43.29 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.488 0.661 . . . . 0.0 109.788 174.088 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -65.93 -27.12 67.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.983 -176.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.3 m -84.08 -9.7 58.4 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.017 177.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 68.75 36.85 83.41 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.367 178.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 41.0 p . . . . . 0 C--N 1.321 -0.634 0 CA-C-O 120.947 0.403 . . . . 0.0 111.337 -176.402 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 81.5 mttt . . . . . 0 C--O 1.222 -0.343 0 CA-C-O 120.967 0.413 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -62.59 -23.2 66.91 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.395 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 106' ' ' PHE . . . . . 0.467 ' CE2' HG22 ' A' ' 48' ' ' THR . 55.6 m-85 -96.22 -51.49 4.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.544 177.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -80.78 -46.71 14.97 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -173.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.77 -49.0 74.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.491 -173.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 109' ' ' LEU . . . . . 0.456 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 89.4 mt -68.99 -9.81 54.25 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -175.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 110' ' ' PHE . . . . . 0.44 ' CE2' ' HA ' ' A' ' 32' ' ' ALA . 5.5 t80 -104.18 -5.9 21.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.109 0.481 . . . . 0.0 110.548 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -76.63 -26.15 54.61 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.966 0.412 . . . . 0.0 110.587 -175.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 64.9 m . . . . . 0 C--O 1.247 0.968 0 CA-C-O 118.603 -0.713 . . . . 0.0 110.131 176.095 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.486 ' CD ' ' H ' ' A' ' 20' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.46 0 N-CA-C 110.364 -0.235 . . . . 0.0 110.364 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.436 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 8.3 t30 73.88 -28.79 0.19 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.287 0.635 . . . . 0.0 111.456 178.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.623 ' HA ' ' HA3' ' A' ' 57' ' ' GLY . 15.9 t -78.9 66.28 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.529 0.681 . . . . 0.0 110.657 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.3 tt -98.5 114.18 65.02 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 174.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.05 109.14 0.45 Allowed 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.996 2.464 . . . . 0.0 112.269 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.44 ' HB3' ' HG2' ' A' ' 27' ' ' PRO . 92.5 mtt180 -135.88 139.09 43.1 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.778 -175.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.599 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 36.3 tt0 -61.36 -41.2 78.33 Favored Pre-proline 0 CA--C 1.54 0.57 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.275 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.599 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 5.0 Cg_endo -50.88 -30.74 31.21 Favored 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 122.061 1.84 . . . . 0.0 112.412 173.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 99.7 mt -68.5 -44.52 74.52 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 43.7 mm -58.62 -49.1 83.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.2 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.92 -47.37 83.03 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.14 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 32.1 m -64.34 -36.01 82.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.886 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.77 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -69.11 -49.51 56.48 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.401 -178.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 90.9 t -57.44 -42.24 80.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-O 120.751 0.31 . . . . 0.0 110.458 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.545 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.7 tmmm? -58.42 -48.11 81.76 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.995 174.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.631 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 80.1 t80 -56.7 -54.86 41.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.7 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.77 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 32.9 mt -58.05 -54.51 46.17 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.533 -174.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -93.59 20.31 7.53 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.656 -173.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -66.87 -53.9 27.69 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 174.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.2 p -172.48 -69.32 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.174 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -91.07 -21.54 21.18 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -167.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.475 ' HB ' ' HA ' ' A' ' 36' ' ' LEU . 40.1 t -67.29 -33.27 61.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.728 -173.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 36' ' ' LEU . 13.1 mmm180 -62.99 -28.49 70.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.019 0.437 . . . . 0.0 110.357 175.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -95.57 -6.32 40.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.976 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.2 t -80.11 136.78 53.48 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.012 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_exo -57.92 143.3 96.21 Favored 'Trans proline' 0 C--O 1.237 0.428 0 C-N-CA 122.963 2.442 . . . . 0.0 111.96 178.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.771 HD11 ' HB3' ' A' ' 75' ' ' ASP . 0.9 OUTLIER -68.72 -19.51 64.36 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.206 -176.953 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -53.29 -42.29 66.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.743 0.306 . . . . 0.0 110.337 172.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 84.7 m -71.22 -53.04 15.76 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.48 172.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.551 HH21 HD22 ' A' ' 46' ' ' LEU . 15.6 mtm180 -60.18 -34.2 73.27 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -169.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.431 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 6.1 mpp_? -67.67 -56.77 8.06 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 121.263 -0.175 . . . . 0.0 111.332 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.465 ' O ' ' HG3' ' A' ' 55' ' ' LYS . . . -59.7 -43.29 94.15 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 177.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.812 ' HD1' HD13 ' A' ' 53' ' ' LEU . 79.6 t80 -50.66 -66.92 0.3 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.414 -178.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.812 HD13 ' HD1' ' A' ' 52' ' ' PHE . 8.2 mp -60.32 -40.03 89.16 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.729 0.299 . . . . 0.0 111.292 -175.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.531 ' HA ' ' O ' ' A' ' 58' ' ' LEU . 60.1 mttm -63.24 -37.76 88.49 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.225 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' A' ' 51' ' ' ALA . 29.6 mtpp -78.64 -27.62 45.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.47 179.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.932 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 9.3 mmpt? -69.75 -25.29 63.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.205 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.623 ' HA3' ' HA ' ' A' ' 22' ' ' VAL . . . 135.65 2.54 2.84 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.157 -1.02 . . . . 0.0 113.02 177.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.531 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 5.8 mp -92.45 126.69 37.64 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.865 0.364 . . . . 0.0 110.459 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.548 HG22 HG11 ' A' ' 22' ' ' VAL . 2.2 p -70.4 173.63 6.66 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 116.244 -0.435 . . . . 0.0 109.952 174.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.6 ' O ' HG23 ' A' ' 63' ' ' ILE . 3.3 m-20 -56.25 -45.07 80.2 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.263 0.554 . . . . 0.0 110.392 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.443 ' O ' ' HG2' ' A' ' 65' ' ' MET . 10.3 pt-20 -56.3 -42.43 77.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.065 177.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -72.29 -33.59 67.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.424 -174.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.725 HG13 HD21 ' A' ' 53' ' ' LEU . 17.4 tt -69.71 -36.27 69.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 120.001 -0.679 . . . . 0.0 110.816 -177.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.66 -28.13 58.62 Favored 'General case' 0 C--O 1.211 -0.969 0 C-N-CA 119.072 -1.051 . . . . 0.0 109.316 173.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.797 ' HE3' ' HA ' ' A' ' 65' ' ' MET . 21.9 mmt -59.45 -51.88 68.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.806 0.336 . . . . 0.0 110.246 175.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.94 -42.29 99.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.074 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.504 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 6.8 m-85 -73.13 -29.05 62.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.941 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -71.48 -40.45 70.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.217 0.532 . . . . 0.0 109.8 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' A' ' 65' ' ' MET . 14.5 mm100 -69.95 -39.99 75.72 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.113 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 27.1 p -78.11 -24.28 47.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.022 0.439 . . . . 0.0 110.857 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 73.43 70.36 1.25 Allowed Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 121.091 -0.576 . . . . 0.0 113.151 174.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.0 p -88.11 -55.68 3.65 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.218 -0.289 . . . . 0.0 110.218 174.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 50.96 69.04 0.69 Allowed 'General case' 0 C--O 1.234 0.254 0 O-C-N 123.867 0.729 . . . . 0.0 112.088 175.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -144.72 -86.57 0.12 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.305 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.771 ' HB3' HD11 ' A' ' 46' ' ' LEU . 11.3 t70 -118.4 87.2 2.68 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 174.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.68 -166.182 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 6.1 p . . . . . 0 N--CA 1.473 0.724 0 CA-C-O 121.166 0.508 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 -72.86 -31.68 64.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.523 -178.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -60.06 -46.1 90.68 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.423 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -67.62 -27.33 66.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.407 178.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -62.52 -32.52 73.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.523 178.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' PHE . . . . . 0.631 ' HD2' ' HZ ' ' A' ' 35' ' ' PHE . 62.1 m-85 -76.99 -26.67 54.15 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.435 0.636 . . . . 0.0 110.141 178.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -91.55 -61.44 1.64 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.841 -172.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -60.25 -45.83 91.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.614 -175.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.545 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 34.6 tp -68.22 -30.92 70.09 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.532 -174.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' PHE . . . . . 0.616 ' HE2' ' HA ' ' A' ' 32' ' ' ALA . 8.5 t80 -92.45 -16.57 25.69 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.803 -177.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -59.37 -43.92 92.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.228 0.537 . . . . 0.0 110.051 176.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 37.6 m . . . . . 0 C--O 1.251 1.159 0 CA-C-N 115.219 -0.901 . . . . 0.0 109.538 177.698 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 . . . . . 0 N--CA 1.461 0.089 0 CA-C-O 120.749 0.309 . . . . 0.0 111.491 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -92.17 26.8 2.39 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.19 0.519 . . . . 0.0 110.572 -176.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.8 p -104.57 13.93 7.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.95 -179.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 66.1 tp -56.2 105.4 0.52 Allowed Pre-proline 0 N--CA 1.463 0.206 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.417 -176.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.763 ' HB2' ' HG3' ' A' ' 62' ' ' GLU . 96.5 Cg_endo -92.09 112.95 0.31 Allowed 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 123.178 2.585 . . . . 0.0 112.411 -176.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 66.8 mtm180 -134.01 169.8 16.58 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.979 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.544 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 8.8 tp10 -53.87 -50.9 81.3 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -176.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.544 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 10.2 Cg_endo -52.48 -28.26 35.25 Favored 'Trans proline' 0 C--N 1.36 1.154 0 C-N-CA 122.745 2.297 . . . . 0.0 113.359 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 57' ' ' GLY . 4.4 mm? -68.59 -44.78 73.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.781 0.324 . . . . 0.0 110.519 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.43 ' O ' HG21 ' A' ' 33' ' ' VAL . 46.2 mm -60.89 -49.89 82.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.479 -179.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.13 -47.69 80.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.502 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 28.1 m -65.99 -37.61 86.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.742 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.787 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -67.24 -48.51 67.58 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.042 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.43 HG21 ' O ' ' A' ' 29' ' ' ILE . 84.3 t -58.76 -42.58 85.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-O 120.552 0.215 . . . . 0.0 110.826 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.495 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.6 tmmm? -55.75 -46.01 77.94 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.274 0.559 . . . . 0.0 109.918 174.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.514 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 73.9 t80 -61.53 -52.61 63.75 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.718 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.946 ' HA ' HG12 ' A' ' 41' ' ' VAL . 54.5 mt -57.92 -37.57 74.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.042 -173.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -96.96 34.5 1.71 Allowed 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 120.836 0.351 . . . . 0.0 111.576 -177.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -94.06 28.69 2.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.157 0.503 . . . . 0.0 110.15 175.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.2 t 69.04 -67.47 0.21 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.704 176.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -64.92 -22.86 67.07 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.28 -175.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.946 HG12 ' HA ' ' A' ' 36' ' ' LEU . 40.9 t -68.73 -33.1 57.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -178.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -80.7 -18.26 48.46 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.044 0.449 . . . . 0.0 110.628 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -86.82 -35.34 19.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.323 0.582 . . . . 0.0 109.459 173.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.485 ' CB ' HH12 ' A' ' 49' ' ' ARG . 43.2 t -65.26 133.45 95.52 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.224 176.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -42.91 128.37 5.19 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 124.206 3.271 . . . . 0.0 114.272 -174.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.506 ' HA ' ' CG ' ' A' ' 49' ' ' ARG . 4.6 mp -64.57 -20.24 66.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.948 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -55.39 -44.17 75.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.435 173.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.1 m -67.14 -40.92 86.8 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.822 174.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.531 ' HB3' ' CZ ' ' A' ' 67' ' ' PHE . 16.9 mmp_? -52.59 -48.84 66.01 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.525 -174.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -58.68 -61.41 2.63 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.642 0.258 . . . . 0.0 111.633 -176.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.08 -42.12 97.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.782 -178.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.687 ' HD1' HD11 ' A' ' 53' ' ' LEU . 58.4 t80 -51.78 -58.22 7.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.258 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.814 HD21 HG13 ' A' ' 63' ' ' ILE . 8.0 mp -60.58 -44.89 95.69 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 121.049 -0.26 . . . . 0.0 111.221 -177.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.422 ' HZ2' ' CG ' ' A' ' 60' ' ' ASP . 94.8 mttt -67.46 -30.9 70.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.044 0.45 . . . . 0.0 111.544 -175.072 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.8 mmtm -78.54 -22.92 46.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.537 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.437 ' HD2' ' O ' ' A' ' 52' ' ' PHE . 1.0 OUTLIER -74.46 -41.31 61.0 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.587 175.733 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.52 ' O ' ' HG ' ' A' ' 28' ' ' LEU . . . 148.2 69.66 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.178 -1.011 . . . . 0.0 113.532 175.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.655 HD12 ' HB3' ' A' ' 53' ' ' LEU . 3.5 pp -166.1 150.82 8.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.854 0.359 . . . . 0.0 110.452 174.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.4 p -90.35 178.17 6.2 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.775 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.444 ' HA ' HG23 ' A' ' 63' ' ' ILE . 1.0 OUTLIER -55.23 -40.09 70.46 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -178.567 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -64.48 -35.64 81.59 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.001 0.429 . . . . 0.0 110.867 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.763 ' HG3' ' HB2' ' A' ' 24' ' ' PRO . 15.0 mm-40 -79.72 -29.1 40.56 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -177.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.814 HG13 HD21 ' A' ' 53' ' ' LEU . 11.6 tt -70.26 -37.06 70.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.043 -0.663 . . . . 0.0 111.083 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -77.47 -19.12 56.43 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 119.088 -1.045 . . . . 0.0 110.16 171.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.965 ' HE1' ' HA ' ' A' ' 65' ' ' MET . 0.7 OUTLIER -61.82 -46.15 90.73 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 171.874 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.83 -46.37 45.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.536 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.567 ' CD1' HD11 ' A' ' 36' ' ' LEU . 0.9 OUTLIER -71.06 -41.64 70.47 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -176.814 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -67.73 -42.57 81.66 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.966 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -61.22 -39.73 91.37 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.901 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.427 ' HB3' HG12 ' A' ' 33' ' ' VAL . 25.0 p -74.7 -6.93 51.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.869 0.366 . . . . 0.0 111.225 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 84.44 8.34 83.42 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 121.01 -0.614 . . . . 0.0 111.899 178.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.2 m -85.64 96.34 9.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.889 0.376 . . . . 0.0 110.731 -177.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.99 81.62 2.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.204 0.526 . . . . 0.0 110.035 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.501 ' HB3' HD21 ' A' ' 46' ' ' LEU . . . -93.63 44.44 1.13 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.227 -177.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.9 t70 57.97 -141.07 0.75 Allowed 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 -174.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 . . . . . 0 C--N 1.323 -0.563 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 168.601 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 19.1 p . . . . . 0 N--CA 1.475 0.809 0 CA-C-O 120.561 0.219 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -75.44 -25.85 57.81 Favored 'General case' 0 C--N 1.334 -0.084 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -175.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.29 -35.36 79.31 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.115 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -71.9 -35.11 69.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.16 0.505 . . . . 0.0 110.134 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -59.85 -35.55 75.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.348 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' PHE . . . . . 0.532 ' HB3' ' CE2' ' A' ' 52' ' ' PHE . 20.1 m-85 -77.13 -24.77 51.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.227 179.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -93.94 -59.12 2.05 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.784 -174.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.3 -30.73 71.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.816 -171.058 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.495 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 87.6 mt -77.17 -29.54 54.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.705 0.288 . . . . 0.0 111.063 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' PHE . . . . . 0.405 ' CD1' ' HG2' ' A' ' 56' ' ' LYS . 1.1 t80 -90.19 -6.31 55.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.226 0.536 . . . . 0.0 110.19 -178.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -62.26 -52.5 63.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.409 177.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.249 1.051 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.502 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.654 ' HB2' HG21 ' A' ' 22' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.43 0 CA-C-O 121.21 0.529 . . . . 0.0 111.009 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.48 ' O ' ' HA3' ' A' ' 57' ' ' GLY . 95.4 m-20 67.96 29.42 6.5 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.281 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.928 HG13 HG23 ' A' ' 59' ' ' THR . 16.5 t -92.8 66.66 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.549 ' O ' ' HA ' ' A' ' 58' ' ' LEU . 54.4 tp -98.63 108.03 46.02 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.033 -0.985 . . . . 0.0 112.004 -171.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -86.79 94.38 0.51 Allowed 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.535 2.157 . . . . 0.0 112.258 176.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.403 ' HD3' HD23 ' A' ' 23' ' ' LEU . 79.4 mtp180 -134.03 142.61 47.67 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.231 0.538 . . . . 0.0 112.134 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.503 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 15.4 tp10 -55.16 -52.36 71.9 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 114.765 -1.107 . . . . 0.0 112.556 177.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 10.6 Cg_endo -55.43 -35.17 91.47 Favored 'Trans proline' 0 C--N 1.358 1.071 0 C-N-CA 122.371 2.047 . . . . 0.0 112.768 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 57' ' ' GLY . 0.6 OUTLIER -64.67 -44.18 91.2 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -178.538 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.1 mt -58.62 -42.97 86.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.484 178.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.04 -44.58 97.19 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.308 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.3 m -69.02 -35.24 76.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.859 178.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.559 ' O ' HD11 ' A' ' 36' ' ' LEU . . . -62.35 -45.12 94.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.195 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.7 t -67.5 -36.66 77.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.708 0.29 . . . . 0.0 110.38 178.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.579 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.5 tmtm? -56.8 -52.38 65.29 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.209 0.528 . . . . 0.0 109.594 173.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.511 ' O ' HG23 ' A' ' 41' ' ' VAL . 85.6 t80 -56.11 -51.96 66.02 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.043 177.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.559 HD11 ' O ' ' A' ' 32' ' ' ALA . 2.8 mp -52.08 -58.25 7.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.4 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -92.58 43.21 1.12 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.294 0.569 . . . . 0.0 111.828 -173.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -75.83 -56.62 4.5 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 167.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.8 p 173.16 -64.75 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.402 176.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.43 ' HE ' ' HB2' ' A' ' 40' ' ' ARG . 15.3 ttm180 -80.22 -25.73 39.48 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.728 -170.072 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 35' ' ' PHE . 74.0 t -58.13 -38.57 68.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -171.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.7 mtm180 -74.88 -11.83 60.22 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.921 0.391 . . . . 0.0 110.851 -177.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -106.69 2.16 25.6 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.111 0.482 . . . . 0.0 110.198 177.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 41.5 m -85.07 144.02 40.69 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.722 177.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -49.94 122.13 8.59 Favored 'Trans proline' 0 C--O 1.237 0.472 0 C-N-CA 122.964 2.443 . . . . 0.0 112.555 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.68 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 37.0 mt -62.55 -20.09 64.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.312 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -49.58 -49.09 47.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.835 0.35 . . . . 0.0 110.674 172.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.483 HG22 ' CZ ' ' B' ' 106' ' ' PHE . 63.6 m -70.42 -42.91 70.97 Favored 'General case' 0 C--O 1.22 -0.485 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 173.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.657 ' HB2' ' HA ' ' A' ' 46' ' ' LEU . 0.8 OUTLIER -53.34 -44.98 68.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.389 -174.212 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.68 ' HG2' ' O ' ' A' ' 46' ' ' LEU . 30.3 mmt180 -64.23 -61.69 2.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.827 0.346 . . . . 0.0 110.313 -177.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.98 -33.37 71.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.808 -177.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.663 ' HD1' HD11 ' A' ' 53' ' ' LEU . 72.4 t80 -54.69 -56.19 21.77 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.707 -0.678 . . . . 0.0 111.605 179.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.663 HD11 ' HD1' ' A' ' 52' ' ' PHE . 9.7 mp -63.66 -39.11 93.51 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.83 -0.348 . . . . 0.0 111.056 -178.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.717 ' HE2' HD11 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -66.77 -38.24 86.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.885 0.374 . . . . 0.0 111.646 -179.572 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.825 ' HZ2' ' HA ' ' A' ' 55' ' ' LYS . 0.8 OUTLIER -79.87 -30.02 40.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 179.606 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.671 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -70.75 -28.67 64.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.03 0.443 . . . . 0.0 110.599 -176.416 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.584 ' O ' ' HG ' ' A' ' 28' ' ' LEU . . . 128.86 64.78 0.11 Allowed Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.213 177.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.549 ' HA ' ' O ' ' A' ' 23' ' ' LEU . 15.2 tp -160.6 155.65 24.44 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 -178.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.928 HG23 HG13 ' A' ' 22' ' ' VAL . 4.5 p -95.4 163.34 13.28 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.771 ' O ' HG12 ' A' ' 63' ' ' ILE . 4.9 m-20 -55.66 -37.99 68.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.679 0.276 . . . . 0.0 111.33 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -52.52 -52.13 56.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.95 0.405 . . . . 0.0 111.514 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.422 ' HB2' ' HG ' ' A' ' 58' ' ' LEU . 8.8 mp0 -72.49 -25.34 61.38 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.423 -176.086 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.771 HG12 ' O ' ' A' ' 60' ' ' ASP . 8.1 pt -64.12 -38.85 83.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 C-N-CA 119.695 -0.802 . . . . 0.0 110.718 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.11 -30.84 63.93 Favored 'General case' 0 C--O 1.206 -1.204 0 C-N-CA 119.361 -0.936 . . . . 0.0 109.001 173.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.786 ' HA ' ' HE2' ' A' ' 65' ' ' MET . 2.4 tpt -59.01 -45.17 91.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.088 0.471 . . . . 0.0 109.967 177.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.31 -48.96 54.26 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.147 177.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.462 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.3 m-85 -65.73 -32.35 73.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.841 -178.075 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -67.93 -44.53 76.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.441 0.639 . . . . 0.0 109.548 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -70.95 -28.83 64.77 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.668 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.9 t -73.15 -15.23 61.47 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.571 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.96 -4.65 75.24 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.09 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 18.4 p -79.97 68.49 6.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.364 0.602 . . . . 0.0 111.197 -177.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.36 52.17 2.43 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.492 179.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -132.51 125.69 31.18 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.07 -178.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.9 t70 71.72 133.16 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 O-C-N 124.098 0.874 . . . . 0.0 110.345 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.877 -175.482 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 120.613 0.244 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -72.33 -14.63 61.79 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -173.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -53.97 -32.24 53.31 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 111.803 0.298 . . . . 0.0 111.803 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -65.21 -38.78 91.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.954 0.407 . . . . 0.0 110.723 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' PHE . . . . . 0.449 ' O ' ' HE1' ' A' ' 35' ' ' PHE . 82.5 t80 -66.4 -27.66 68.02 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.785 -178.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' PHE . . . . . 0.575 ' HB3' ' CE2' ' A' ' 52' ' ' PHE . 65.1 m-85 -88.97 -33.99 17.02 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.95 0.405 . . . . 0.0 111.332 -177.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -89.45 -43.9 10.53 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -173.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -68.98 -44.75 72.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.787 0.327 . . . . 0.0 111.061 -175.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.579 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 8.8 mp -72.65 -4.57 31.84 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.474 -176.43 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' PHE . . . . . 0.483 ' CE1' ' HG2' ' A' ' 56' ' ' LYS . 4.5 t80 -104.68 -4.09 22.88 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.926 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -61.58 -64.3 0.99 Allowed 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.378 -177.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 3.0 p . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.75 -0.643 . . . . 0.0 110.906 -179.644 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.127 0 CA-C-O 120.418 0.151 . . . . 0.0 111.385 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 56.32 54.28 7.85 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.164 0.506 . . . . 0.0 110.757 -179.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.822 ' HA ' ' HA3' ' A' ' 57' ' ' GLY . 2.9 p -85.62 12.82 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 176.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.8 tp -56.47 108.8 1.33 Allowed Pre-proline 0 C--O 1.232 0.178 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.906 -175.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -50.49 105.72 0.11 Allowed 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 123.589 2.86 . . . . 0.0 112.911 -179.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.577 ' HB2' HD22 ' A' ' 28' ' ' LEU . 61.6 mtp180 -137.19 128.75 28.51 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.495 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.629 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 32.0 mt-10 -56.92 -35.75 39.06 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -176.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.629 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 4.3 Cg_endo -49.64 -29.76 20.25 Favored 'Trans proline' 0 C--N 1.358 1.079 0 C-N-CA 122.197 1.931 . . . . 0.0 112.996 172.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.577 HD22 ' HB2' ' A' ' 25' ' ' ARG . 4.3 mm? -66.08 -30.97 71.57 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.758 0.313 . . . . 0.0 110.764 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.412 ' O ' HG22 ' A' ' 33' ' ' VAL . 44.9 mm -62.39 -42.95 97.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.868 177.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.3 -46.27 84.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.15 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.6 m -61.73 -41.73 98.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.934 0.397 . . . . 0.0 110.483 177.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.537 ' O ' HD12 ' A' ' 36' ' ' LEU . . . -63.59 -45.3 91.01 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.77 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.412 HG22 ' O ' ' A' ' 29' ' ' ILE . 72.3 t -63.88 -39.97 87.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.664 0.269 . . . . 0.0 110.764 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.431 ' HE2' ' O ' ' B' ' 109' ' ' LEU . 0.8 OUTLIER -55.83 -50.5 70.37 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.199 0.524 . . . . 0.0 110.219 174.754 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.421 ' N ' ' HD3' ' A' ' 34' ' ' LYS . 84.4 t80 -59.82 -56.25 24.06 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.638 178.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.537 HD12 ' O ' ' A' ' 32' ' ' ALA . 1.8 mp -50.78 -57.74 7.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.985 -1.007 . . . . 0.0 112.565 -177.088 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.406 ' HG2' ' HD3' ' A' ' 42' ' ' ARG . 35.3 mt-30 -95.28 32.64 1.7 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.641 -171.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -70.1 -63.08 1.15 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 173.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.8 p -167.57 -68.17 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.513 -178.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -96.62 -15.25 21.63 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -171.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.456 ' HB ' ' O ' ' A' ' 36' ' ' LEU . 85.6 t -59.78 -43.44 91.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 112.81 0.671 . . . . 0.0 112.81 -171.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.406 ' HD3' ' HG2' ' A' ' 37' ' ' GLN . 60.1 mtm180 -68.07 -19.03 64.83 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.126 -178.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -92.86 -15.92 25.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.253 0.549 . . . . 0.0 110.456 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 31.0 m -72.24 152.41 92.36 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.119 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -43.31 124.99 4.26 Favored 'Trans proline' 0 C--O 1.237 0.44 0 C-N-CA 123.731 2.954 . . . . 0.0 113.012 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.617 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 5.7 mp -69.28 -33.06 72.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.284 -178.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -55.76 -43.93 77.18 Favored 'General case' 0 C--O 1.234 0.24 0 O-C-N 123.444 0.465 . . . . 0.0 110.632 176.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.501 HG22 ' CZ ' ' B' ' 106' ' ' PHE . 99.9 m -55.97 -52.41 64.27 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.146 173.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.701 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 61.6 mtm180 -65.28 -21.49 66.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.487 -175.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.617 ' HG2' ' O ' ' A' ' 46' ' ' LEU . 32.5 mmt180 -66.56 -61.0 2.21 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 175.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.87 -42.94 94.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.022 177.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.677 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 80.2 t80 -49.48 -61.08 2.3 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.985 178.002 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.771 ' HG ' HG13 ' A' ' 63' ' ' ILE . 2.8 mm? -53.12 -42.63 66.21 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -177.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.464 ' HD3' ' O ' ' A' ' 50' ' ' ARG . 1.7 mptm? -67.46 -36.82 81.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.858 0.361 . . . . 0.0 111.136 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -78.2 -23.51 47.5 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.143 -0.481 . . . . 0.0 112.078 -177.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.677 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 19.7 mmmt -79.64 -29.11 40.9 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.922 -178.062 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.822 ' HA3' ' HA ' ' A' ' 22' ' ' VAL . . . 128.39 37.98 0.39 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.84 178.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.7 mp -130.12 132.45 46.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.829 0.347 . . . . 0.0 110.35 177.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 20.8 p -79.03 176.94 9.19 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.604 176.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.48 ' HA ' HG23 ' A' ' 63' ' ' ILE . 8.4 m-20 -59.59 -38.53 81.45 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 -174.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.416 ' HG3' ' HG3' ' A' ' 62' ' ' GLU . 8.5 pt-20 -65.42 -33.33 75.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.262 0.553 . . . . 0.0 110.792 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.416 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 45.3 mt-10 -79.87 -37.03 35.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.627 -176.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.771 HG13 ' HG ' ' A' ' 53' ' ' LEU . 4.6 tt -64.08 -42.74 96.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.953 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.669 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 4.2 p30 -77.98 -19.43 54.5 Favored 'General case' 0 C--O 1.205 -1.274 0 C-N-CA 118.684 -1.207 . . . . 0.0 110.649 174.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.912 ' HE1' ' HA ' ' A' ' 65' ' ' MET . 0.5 OUTLIER -61.91 -47.33 85.43 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.674 173.935 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.94 -41.12 64.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.921 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.701 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.1 m-85 -73.03 -31.64 64.57 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -178.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.669 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 4.2 tp-100 -67.0 -47.81 70.36 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -70.32 -31.27 68.51 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.755 -177.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.407 ' HG ' ' HA ' ' A' ' 67' ' ' PHE . 12.5 p -73.86 -9.14 58.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.747 0.308 . . . . 0.0 111.269 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 84.46 27.27 36.48 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.917 -0.659 . . . . 0.0 113.404 173.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 69.7 p -78.54 -73.04 0.34 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 177.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 52.8 42.25 31.84 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.124 0.488 . . . . 0.0 112.052 174.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -90.02 -45.49 9.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.395 177.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -160.9 173.65 14.99 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.211 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 . . . . . 0 C--N 1.324 -0.508 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.493 -177.626 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 11.8 p . . . . . 0 N--CA 1.477 0.899 0 CA-C-O 121.276 0.56 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -67.69 -51.5 48.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.851 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -59.68 -44.18 93.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.129 0.49 . . . . 0.0 110.642 -176.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -60.85 -31.06 70.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.825 -179.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -73.07 -34.91 66.53 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.443 -179.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' PHE . . . . . 0.501 ' CZ ' HG22 ' A' ' 48' ' ' THR . 24.7 m-85 -80.37 -20.73 43.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.762 -175.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -98.16 -62.73 1.2 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.701 0.286 . . . . 0.0 111.375 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -64.38 -36.02 82.79 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -170.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.431 ' O ' ' HE2' ' A' ' 34' ' ' LYS . 0.5 OUTLIER -79.99 -4.85 54.3 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.872 0.367 . . . . 0.0 110.887 -173.93 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' PHE . . . . . 0.553 ' CE1' ' HB3' ' A' ' 56' ' ' LYS . 12.9 t80 -100.34 -4.66 28.71 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.847 0.356 . . . . 0.0 110.721 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -56.68 -52.15 66.03 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.861 -178.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 7.4 t . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.121 -0.942 . . . . 0.0 109.221 -178.804 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.5 ' CD ' ' H ' ' A' ' 20' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.267 0 CA-C-O 120.66 0.267 . . . . 0.0 111.526 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.422 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 18.0 m120 73.05 0.83 3.82 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.188 -176.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.415 HG22 ' OE2' ' A' ' 20' ' ' GLU . 7.2 t 41.55 78.99 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 114.887 -1.051 . . . . 0.0 112.905 173.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.443 ' HA ' ' HD2' ' A' ' 24' ' ' PRO . 4.3 mm? -97.75 108.2 44.41 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.109 174.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.443 ' HD2' ' HA ' ' A' ' 23' ' ' LEU . 24.4 Cg_endo -61.79 83.14 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.954 2.436 . . . . 0.0 111.711 177.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.404 HH21 HD21 ' A' ' 28' ' ' LEU . 88.4 mtm180 -105.06 133.72 49.37 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.621 -176.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.533 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 38.8 mt-10 -65.34 -45.21 70.11 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.078 -0.965 . . . . 0.0 112.297 -177.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.533 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 19.5 Cg_endo -62.69 -22.97 74.46 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 121.923 1.749 . . . . 0.0 112.268 175.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.427 ' O ' ' HB ' ' A' ' 31' ' ' THR . 38.8 tp -71.71 -33.11 68.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.9 178.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.513 ' O ' HG21 ' A' ' 33' ' ' VAL . 66.1 mt -62.19 -45.43 98.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 174.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.63 -29.37 70.62 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.651 177.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.427 ' HB ' ' O ' ' A' ' 28' ' ' LEU . 55.3 m -66.6 -43.55 84.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.464 174.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.549 ' O ' HD12 ' A' ' 36' ' ' LEU . . . -62.41 -44.57 96.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.578 178.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.513 HG21 ' O ' ' A' ' 29' ' ' ILE . 40.3 t -61.46 -43.66 97.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.321 178.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.413 ' HD2' ' N ' ' A' ' 35' ' ' PHE . 3.3 tmmm? -53.27 -51.4 62.39 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.333 0.587 . . . . 0.0 110.359 174.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.437 ' CD2' HG12 ' A' ' 41' ' ' VAL . 85.4 t80 -55.76 -52.12 65.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.422 178.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.577 HD23 ' CD1' ' A' ' 67' ' ' PHE . 5.4 mp -58.01 -51.72 68.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.188 -0.915 . . . . 0.0 113.159 -176.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -79.93 34.54 0.29 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -167.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -100.79 29.26 4.64 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 168.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.0 m 72.31 -65.85 0.33 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 114.624 -1.171 . . . . 0.0 112.078 176.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.8 mtp180 -57.0 -44.27 82.58 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -175.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.437 HG12 ' CD2' ' A' ' 35' ' ' PHE . 47.3 t -62.0 -39.29 83.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.844 -174.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.404 ' HG3' ' O ' ' A' ' 36' ' ' LEU . 55.7 mtm180 -70.37 -13.01 61.96 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.932 -178.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.2 mm-40 -115.59 8.74 15.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.36 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 97.5 p -87.39 154.92 54.34 Favored Pre-proline 0 C--N 1.329 -0.294 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -49.18 116.58 2.31 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.869 2.38 . . . . 0.0 113.027 -178.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.487 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 23.2 mt -58.14 -27.9 64.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.343 177.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.82 -42.45 71.91 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.94 0.4 . . . . 0.0 110.812 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 99.7 m -70.41 -49.82 44.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.216 175.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.823 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 61.0 mtm180 -62.23 -26.42 68.36 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.514 -173.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.554 ' NH1' HD13 ' A' ' 63' ' ' ILE . 22.6 mmm180 -61.21 -61.96 2.19 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.932 0.396 . . . . 0.0 110.61 176.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.71 -32.2 73.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.201 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.658 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 91.6 t80 -54.93 -55.81 26.53 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.862 177.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.899 HD11 ' HB ' ' A' ' 63' ' ' ILE . 19.6 mt -59.55 -44.67 93.17 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.077 0.236 . . . . 0.0 111.026 -177.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 1.115 ' HE2' HD12 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -58.51 -44.44 89.47 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.94 0.4 . . . . 0.0 111.032 -179.577 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 55' ' ' LYS . 31.4 mmtp -70.35 -21.38 62.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.584 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.909 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -73.29 -21.63 60.55 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 121.07 -0.252 . . . . 0.0 111.109 179.07 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.05 32.67 1.49 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.399 -0.905 . . . . 0.0 114.211 173.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.747 HD13 ' HB3' ' A' ' 53' ' ' LEU . 1.4 pp -139.37 142.53 37.55 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 117.479 0.639 . . . . 0.0 110.711 175.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.421 ' O ' HG22 ' A' ' 63' ' ' ILE . 1.1 p -70.19 161.89 29.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.828 -0.624 . . . . 0.0 112.524 -172.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.576 ' O ' HG12 ' A' ' 63' ' ' ILE . 6.3 t70 -50.04 -49.13 52.11 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.093 0.557 . . . . 0.0 111.57 -174.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.485 ' HG3' ' HG2' ' A' ' 62' ' ' GLU . 9.4 pt-20 -53.01 -38.69 62.55 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.677 178.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.485 ' HG2' ' HG3' ' A' ' 61' ' ' GLU . 4.7 mm-40 -78.41 -26.51 46.44 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.752 -175.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 1.115 HD12 ' HE2' ' A' ' 54' ' ' LYS . 1.7 pt -67.4 -38.66 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.872 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.65 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 0.3 OUTLIER -75.33 -27.99 59.46 Favored 'General case' 0 C--O 1.212 -0.871 0 C-N-CA 119.801 -0.76 . . . . 0.0 109.246 177.539 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.808 ' HA ' ' HE2' ' A' ' 65' ' ' MET . 2.0 tpt -61.26 -48.49 81.17 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 176.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.62 -47.22 73.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.911 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.823 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 1.4 m-85 -64.62 -37.46 87.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.593 -179.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.65 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 0.5 OUTLIER -60.62 -53.92 51.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.749 0.785 . . . . 0.0 109.237 177.427 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -62.35 -35.09 78.05 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 113.982 -1.463 . . . . 0.0 111.805 -175.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 24.2 m -82.15 -5.33 58.38 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -176.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.74 61.48 6.16 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.054 -0.593 . . . . 0.0 111.777 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 39.9 p -133.02 2.11 3.61 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -172.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -114.54 132.12 56.42 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.778 0.323 . . . . 0.0 110.709 -176.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.53 -37.55 78.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.532 0.682 . . . . 0.0 109.452 174.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -161.45 -46.57 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 173.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 . . . . . 0 C--N 1.326 -0.434 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.038 172.318 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 13.4 p . . . . . 0 N--CA 1.476 0.842 0 N-CA-C 110.634 -0.136 . . . . 0.0 110.634 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -53.98 -41.57 68.01 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -174.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -60.82 -55.4 33.54 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.638 0.236 . . . . 0.0 111.638 -177.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 34.6 mttp -59.65 -33.87 72.09 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.013 0.435 . . . . 0.0 111.232 179.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -76.54 -22.26 54.6 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 120.739 -0.385 . . . . 0.0 111.053 -178.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -96.55 -32.1 12.43 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 119.798 -0.761 . . . . 0.0 111.477 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -98.36 -48.77 4.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.88 0.372 . . . . 0.0 111.859 -177.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -80.88 -32.0 35.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.445 -172.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.416 ' O ' HD11 ' B' ' 109' ' ' LEU . 1.9 tm? -58.77 -31.53 68.46 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.133 0.492 . . . . 0.0 109.855 179.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' PHE . . . . . 0.536 ' CD1' ' HD3' ' A' ' 56' ' ' LYS . 53.5 t80 -64.81 -53.91 39.4 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.829 -178.467 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -50.08 -65.77 0.51 Allowed 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.414 0.446 . . . . 0.0 111.707 -173.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 26.8 m . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.852 -0.594 . . . . 0.0 110.511 -178.658 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 . . . . . 0 CA--C 1.53 0.202 0 CA-C-O 120.853 0.358 . . . . 0.0 111.419 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 23.9 p30 -107.4 -4.05 18.95 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.835 -175.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.565 ' O ' ' HD3' ' A' ' 24' ' ' PRO . 35.5 m -92.12 95.83 5.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.897 0.856 . . . . 0.0 110.493 178.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.442 ' O ' HD22 ' A' ' 28' ' ' LEU . 92.4 mt -99.14 102.54 16.03 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.681 175.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.565 ' HD3' ' O ' ' A' ' 22' ' ' VAL . 31.8 Cg_exo -63.36 86.71 0.13 Allowed 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 123.043 2.495 . . . . 0.0 111.824 176.359 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.451 ' O ' HG13 ' A' ' 29' ' ' ILE . 99.2 mtt180 -127.35 165.17 20.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.836 -176.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.632 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 44.0 mt-10 -75.94 -42.07 3.51 Favored Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -175.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.632 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 4.9 Cg_endo -48.31 -43.93 30.65 Favored 'Trans proline' 0 C--N 1.358 1.058 0 C-N-CA 122.734 2.289 . . . . 0.0 113.513 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.553 HD13 ' N ' ' A' ' 29' ' ' ILE . 2.3 pp -77.05 -25.96 53.07 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.529 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.553 ' N ' HD13 ' A' ' 28' ' ' LEU . 82.9 mt -65.84 -49.07 79.62 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 N-CA-C 109.389 -0.596 . . . . 0.0 109.389 174.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.44 -40.08 81.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.508 177.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 34.5 m -64.85 -40.78 95.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.612 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.426 ' O ' HD21 ' A' ' 36' ' ' LEU . . . -67.0 -39.36 87.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.242 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.453 HG22 ' O ' ' A' ' 29' ' ' ILE . 90.8 t -62.58 -49.12 85.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.693 -0.231 . . . . 0.0 110.878 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.522 ' HD2' ' N ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -67.71 -32.75 73.6 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.028 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.542 ' CE2' HG12 ' A' ' 41' ' ' VAL . 89.7 t80 -59.15 -53.35 59.3 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.078 177.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.707 HD11 HG13 ' A' ' 41' ' ' VAL . 3.4 mm? -58.79 -49.05 79.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.277 -178.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -92.17 6.89 44.95 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -172.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.407 ' HB2' ' O ' ' A' ' 34' ' ' LYS . 5.0 t30 -60.67 -45.73 93.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.639 0.257 . . . . 0.0 110.778 -177.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.582 ' HB2' ' HZ ' ' B' ' 105' ' ' PHE . 14.7 m -156.5 -67.05 0.11 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.865 0.365 . . . . 0.0 111.294 -176.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.45 ' HA ' ' NE2' ' A' ' 43' ' ' GLN . 5.3 ptp180 -132.46 -8.83 3.28 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -170.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.707 HG13 HD11 ' A' ' 36' ' ' LEU . 58.3 t -57.51 -40.27 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -172.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.744 ' HG3' HG21 ' A' ' 72' ' ' THR . 33.8 ttp180 -66.08 -21.0 66.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.834 0.349 . . . . 0.0 110.326 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.45 ' NE2' ' HA ' ' A' ' 40' ' ' ARG . 0.5 OUTLIER -97.74 -5.46 34.99 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.488 176.332 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.2 m -83.06 156.59 66.87 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.021 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -45.47 126.2 8.28 Favored 'Trans proline' 0 C--O 1.241 0.645 0 C-N-CA 123.8 3.0 . . . . 0.0 113.665 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.795 HD23 ' HB3' ' A' ' 75' ' ' ASP . 6.1 mp -66.66 -24.13 66.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.556 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.46 -44.68 85.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.665 176.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 84.8 m -64.6 -50.34 67.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.318 176.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.708 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 15.6 mtm180 -65.4 -31.36 72.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.215 -172.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 1.1 mtt-85 -66.4 -52.54 45.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.708 0.29 . . . . 0.0 111.045 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.7 -40.18 96.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.052 0.453 . . . . 0.0 109.958 176.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.808 ' HD1' HD13 ' A' ' 53' ' ' LEU . 77.0 t80 -51.73 -68.56 0.16 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.961 -1.018 . . . . 0.0 111.376 177.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.808 HD13 ' HD1' ' A' ' 52' ' ' PHE . 9.8 mp -57.1 -36.22 70.35 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -175.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.45 -36.12 81.99 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.901 178.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -77.26 -23.66 51.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.872 0.368 . . . . 0.0 111.302 176.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.671 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 19.8 mmmt -77.28 -14.5 59.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.522 -178.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.422 ' HA3' ' HA ' ' A' ' 22' ' ' VAL . . . 116.0 22.81 4.46 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.58 -0.819 . . . . 0.0 113.179 176.377 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.495 ' HG ' HD11 ' A' ' 28' ' ' LEU . 5.7 mp -108.13 140.77 40.83 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.933 0.367 . . . . 0.0 110.739 177.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.8 p -84.43 174.02 10.41 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.834 172.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.589 ' HA ' HG23 ' A' ' 63' ' ' ILE . 0.4 OUTLIER -59.97 -40.89 90.61 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 -178.726 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -59.91 -40.34 88.52 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.289 0.566 . . . . 0.0 110.551 177.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -79.37 -28.04 41.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.146 -174.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.67 HG13 HD23 ' A' ' 53' ' ' LEU . 9.9 tt -69.53 -40.01 79.14 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.778 -178.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.619 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 0.4 OUTLIER -67.73 -40.52 84.19 Favored 'General case' 0 C--O 1.207 -1.149 0 C-N-CA 119.034 -1.066 . . . . 0.0 108.254 174.701 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.864 ' HE1' ' HA ' ' A' ' 65' ' ' MET . 1.4 tpt -56.11 -42.77 77.36 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 120.958 0.409 . . . . 0.0 111.134 -177.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.44 -44.64 70.87 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.975 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.708 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.6 m-85 -69.43 -29.32 67.01 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.619 ' HG2' ' O ' ' A' ' 64' ' ' ASP . 69.6 mm-40 -62.88 -52.7 62.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.306 0.574 . . . . 0.0 109.757 178.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -67.92 -28.55 67.59 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.921 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.1 t -75.47 -10.01 59.07 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.203 0.525 . . . . 0.0 111.408 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 67.88 43.31 83.67 Favored Glycine 0 N--CA 1.451 -0.357 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.597 176.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.744 HG21 ' HG3' ' A' ' 42' ' ' ARG . 22.0 p -77.04 -64.72 1.07 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.535 0.207 . . . . 0.0 110.745 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 51.41 60.2 4.03 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.586 173.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -127.07 -60.8 1.19 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.839 177.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.795 ' HB3' HD23 ' A' ' 46' ' ' LEU . 32.2 t70 -137.57 145.31 42.7 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 174.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 . . . . . 0 C--N 1.322 -0.592 0 CA-C-O 120.882 0.372 . . . . 0.0 110.668 -174.945 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 30.0 t . . . . . 0 N--CA 1.481 1.11 0 CA-C-O 120.858 0.361 . . . . 0.0 111.289 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 29.9 mm-40 -73.04 -18.46 61.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.428 -172.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -59.84 -32.0 70.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.059 0.457 . . . . 0.0 110.564 175.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.405 ' HE2' ' HB3' ' B' ' 104' ' ' LYS . 46.9 mtpt -75.37 -9.81 58.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.536 -178.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' PHE . . . . . 0.582 ' HZ ' ' HB2' ' A' ' 39' ' ' SER . 39.0 t80 -68.21 -27.47 66.41 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.801 0.334 . . . . 0.0 110.237 -178.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' PHE . . . . . 0.453 ' CD2' ' HZ ' ' A' ' 35' ' ' PHE . 60.6 m-85 -87.61 -23.73 24.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.162 0.506 . . . . 0.0 110.812 176.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -93.46 -64.78 1.05 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.589 -174.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -64.64 -22.04 66.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.61 -170.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.511 HD12 ' HA ' ' B' ' 105' ' ' PHE . 10.6 mp -82.72 -10.74 58.77 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.896 -0.322 . . . . 0.0 111.523 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' PHE . . . . . 0.536 ' CE1' ' HB3' ' A' ' 56' ' ' LYS . 2.7 t80 -101.39 -11.88 19.04 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 119.497 -0.881 . . . . 0.0 110.841 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -71.85 -71.93 0.25 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 173.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 52.0 m . . . . . 0 C--O 1.247 0.951 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.651 172.86 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 . . . . . 0 C--O 1.233 0.231 0 CA-C-O 120.943 0.401 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.0 t30 177.14 -38.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.005 -175.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.833 ' HB ' ' HA ' ' A' ' 59' ' ' THR . 34.7 m -82.94 118.01 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.171 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.555 ' HG ' ' HG2' ' A' ' 25' ' ' ARG . 39.8 tp -99.56 109.02 53.75 Favored Pre-proline 0 C--N 1.318 -0.803 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.663 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.529 ' HA ' ' OE2' ' A' ' 62' ' ' GLU . 14.4 Cg_exo -70.16 91.63 0.55 Allowed 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.822 2.348 . . . . 0.0 112.209 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.555 ' HG2' ' HG ' ' A' ' 23' ' ' LEU . 40.6 mmt180 -143.12 123.86 14.17 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.468 -178.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.647 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 0.5 OUTLIER -67.01 -40.7 30.87 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.374 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.647 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 9.4 Cg_endo -53.22 -35.63 74.49 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 122.145 1.897 . . . . 0.0 112.414 175.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.472 HD21 ' HB2' ' A' ' 58' ' ' LEU . 4.3 tt -76.13 -28.87 57.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.896 0.379 . . . . 0.0 110.027 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.494 HG12 HD12 ' A' ' 58' ' ' LEU . 70.7 mt -60.03 -41.84 87.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 172.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.71 -40.06 95.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.548 176.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.1 m -58.97 -41.07 86.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.3 0.571 . . . . 0.0 110.199 175.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.582 ' O ' HD12 ' A' ' 36' ' ' LEU . . . -67.4 -45.12 77.09 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.076 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.443 HG22 ' O ' ' A' ' 29' ' ' ILE . 73.8 t -62.12 -45.26 99.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -177.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.62 -29.06 69.0 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.108 0.48 . . . . 0.0 110.237 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.467 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 79.9 t80 -66.19 -57.94 6.51 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.414 -0.812 . . . . 0.0 108.995 173.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.582 HD12 ' O ' ' A' ' 32' ' ' ALA . 1.2 mp -50.49 -56.86 9.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.541 -1.209 . . . . 0.0 112.127 -178.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.509 ' HG2' ' HD3' ' A' ' 42' ' ' ARG . 45.9 mt-30 -83.8 34.38 0.49 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -173.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -93.0 25.68 3.12 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 166.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.1 t 73.32 -64.15 0.41 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-N 114.767 -1.106 . . . . 0.0 111.724 178.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -65.53 -23.03 66.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.009 -172.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.483 ' HB ' ' O ' ' A' ' 36' ' ' LEU . 51.8 t -80.57 -37.74 17.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.245 -179.297 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.509 ' HD3' ' HG2' ' A' ' 37' ' ' GLN . 25.8 mtm180 -66.23 -22.7 66.34 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.225 -0.59 . . . . 0.0 109.689 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -99.46 9.92 42.36 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.761 174.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 28.0 t -91.53 142.41 26.84 Favored Pre-proline 0 C--N 1.326 -0.441 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 176.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.403 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 9.6 Cg_endo -49.91 128.39 21.71 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 123.547 2.832 . . . . 0.0 112.695 -178.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.523 ' O ' ' HG3' ' A' ' 50' ' ' ARG . 7.5 mp -60.93 -30.13 70.03 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.753 -178.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -51.23 -46.53 62.3 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 123.638 0.586 . . . . 0.0 110.787 176.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.489 HG22 ' CZ ' ' B' ' 106' ' ' PHE . 98.4 m -70.51 -53.31 16.71 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.358 176.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.482 ' NH2' ' HG ' ' A' ' 46' ' ' LEU . 16.7 mtm180 -55.39 -44.89 76.54 Favored 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.646 0.591 . . . . 0.0 112.235 -171.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.557 ' O ' ' HD3' ' A' ' 54' ' ' LYS . 67.1 mtm180 -63.16 -54.86 31.09 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.85 -176.049 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.484 ' O ' ' HG2' ' A' ' 55' ' ' LYS . . . -60.48 -43.46 96.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.953 0.406 . . . . 0.0 110.357 178.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.658 ' HD1' HD11 ' A' ' 53' ' ' LEU . 72.2 t80 -49.6 -57.6 6.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.727 178.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.658 HD11 ' HD1' ' A' ' 52' ' ' PHE . 8.6 mp -57.67 -43.99 85.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.717 -0.22 . . . . 0.0 111.38 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.824 ' HE3' HD11 ' A' ' 63' ' ' ILE . 2.2 mptm? -61.64 -46.68 88.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.777 0.322 . . . . 0.0 110.983 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 51' ' ' ALA . 14.5 mmmm -72.23 -23.87 61.3 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.9 -173.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.754 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 10.3 mmpt? -74.59 -19.2 60.41 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.767 0.317 . . . . 0.0 110.413 177.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.25 51.68 0.35 Allowed Glycine 0 N--CA 1.444 -0.776 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.444 177.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.556 HD21 HG21 ' A' ' 63' ' ' ILE . 22.8 tp -142.19 141.32 32.57 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -179.222 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.833 ' HA ' ' HB ' ' A' ' 22' ' ' VAL . 1.2 m -76.18 157.02 33.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.713 -178.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.737 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 23.0 p-10 -60.75 -45.87 92.65 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -178.148 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.627 ' HG3' ' HG3' ' A' ' 62' ' ' GLU . 7.3 pt-20 -52.61 -37.52 58.46 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.699 0.762 . . . . 0.0 111.104 177.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.627 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 47.5 mt-10 -78.91 -27.3 43.78 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.915 -174.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.824 HD11 ' HE3' ' A' ' 54' ' ' LYS . 3.7 pt -70.51 -34.6 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.177 177.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.504 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 0.6 OUTLIER -68.44 -31.79 71.36 Favored 'General case' 0 C--O 1.209 -1.066 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 176.304 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 37.9 tpp -66.97 -42.68 84.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.843 0.354 . . . . 0.0 110.324 177.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.91 -47.46 83.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.151 176.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.475 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 6.9 m-85 -66.49 -31.68 72.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.0 177.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.504 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 0.9 OUTLIER -65.06 -49.74 68.89 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.314 0.578 . . . . 0.0 109.601 -179.278 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -67.22 -30.88 70.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.048 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 32.4 m -83.37 7.74 15.75 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.492 -178.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 61.38 36.89 93.19 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 116.12 -0.491 . . . . 0.0 112.357 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.9 p -130.84 40.9 3.43 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.036 0.446 . . . . 0.0 111.341 -175.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.2 53.37 2.24 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.511 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -83.57 115.02 21.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.576 178.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.447 ' CG ' ' H ' ' A' ' 76' ' ' GLU . 10.4 t70 64.44 -159.68 0.29 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 -174.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.447 ' H ' ' CG ' ' A' ' 75' ' ' ASP . 58.4 mm-40 . . . . . 0 C--N 1.319 -0.748 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 44.7 m . . . . . 0 N--CA 1.475 0.81 0 CA-C-O 121.013 0.435 . . . . 0.0 110.438 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -96.87 -39.18 9.53 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.974 -177.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . 0.441 ' HA ' ' HD1' ' B' ' 106' ' ' PHE . 42.9 mt-10 -61.76 -29.26 70.01 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -170.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -61.57 -32.89 73.0 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.065 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -75.85 -17.38 59.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.8 0.333 . . . . 0.0 110.216 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' PHE . . . . . 0.559 ' HB3' ' CE2' ' A' ' 52' ' ' PHE . 56.4 m-85 -95.22 -18.61 20.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.4 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -97.8 -62.86 1.19 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.144 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -57.24 -48.02 79.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.18 0.514 . . . . 0.0 110.691 -175.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.488 ' O ' HD11 ' B' ' 109' ' ' LEU . 0.5 OUTLIER -70.91 -22.67 62.22 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.65 -176.089 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' PHE . . . . . 0.44 ' HE2' ' HA ' ' A' ' 32' ' ' ALA . 51.1 t80 -93.08 -43.33 8.93 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.078 -178.001 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -57.24 -43.47 82.96 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.26 -176.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 C--O 1.245 0.837 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.143 176.011 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.425 ' HG2' ' H ' ' A' ' 21' ' ' ASN . 0.9 OUTLIER . . . . . 0 C--O 1.234 0.269 0 CA-C-O 121.346 0.593 . . . . 0.0 110.877 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.425 ' H ' ' HG2' ' A' ' 20' ' ' GLU . 27.7 p-10 -176.87 -171.51 0.37 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.866 -1.061 . . . . 0.0 108.138 177.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.732 HG12 ' HA ' ' A' ' 59' ' ' THR . 45.3 t 61.11 54.78 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-O 122.022 0.915 . . . . 0.0 110.298 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.41 ' O ' ' HG3' ' A' ' 25' ' ' ARG . 2.4 tt -99.76 111.05 60.99 Favored Pre-proline 0 C--N 1.318 -0.764 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.699 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 52.4 Cg_exo -56.59 98.14 0.07 OUTLIER 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.91 2.406 . . . . 0.0 112.599 -178.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 23' ' ' LEU . 82.4 mtp180 -128.42 95.95 4.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.632 -176.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.602 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 34.6 tt0 -56.32 -42.99 99.02 Favored Pre-proline 0 CA--C 1.541 0.616 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.602 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 9.0 Cg_endo -52.63 -30.08 44.02 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 122.033 1.822 . . . . 0.0 112.537 176.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.666 HD21 HD11 ' A' ' 58' ' ' LEU . 7.1 tt -71.17 -22.0 62.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.416 -178.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.657 HD13 ' HB3' ' A' ' 62' ' ' GLU . 47.4 mm -58.74 -46.53 90.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.723 0.297 . . . . 0.0 110.349 176.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.12 -44.59 95.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.103 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 34.7 m -57.44 -38.3 74.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.723 176.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.778 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -68.99 -48.81 62.19 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.389 -179.027 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.41 HG22 ' O ' ' A' ' 29' ' ' ILE . 89.1 t -59.47 -45.57 93.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 111.422 0.156 . . . . 0.0 111.422 -177.647 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.569 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 0.0 OUTLIER -69.27 -23.74 63.88 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.888 0.375 . . . . 0.0 110.584 179.404 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.53 ' HZ ' ' CD2' ' B' ' 106' ' ' PHE . 86.5 t80 -70.48 -54.66 11.38 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.389 -0.596 . . . . 0.0 109.389 174.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.778 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 33.3 mt -57.01 -55.52 33.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.427 -176.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -95.17 28.11 2.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.137 -175.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 34' ' ' LYS . 15.5 t-20 -68.84 -50.6 48.6 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 173.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.4 p -173.49 -68.08 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.414 176.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 55.8 mtp180 -95.41 -20.22 19.27 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -169.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.523 HG21 ' HE2' ' B' ' 105' ' ' PHE . 48.9 t -63.86 -34.97 71.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 CA-C-N 118.022 0.374 . . . . 0.0 111.498 -174.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.6 mmm180 -58.3 -29.85 66.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.882 0.373 . . . . 0.0 110.769 174.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -99.02 -5.19 30.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.521 -177.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 51.0 m -80.93 146.77 60.15 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.229 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.19 134.24 49.82 Favored 'Trans proline' 0 C--O 1.239 0.528 0 C-N-CA 123.023 2.482 . . . . 0.0 112.794 -178.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.465 ' O ' ' HG3' ' A' ' 50' ' ' ARG . 7.8 mp -64.07 -28.02 69.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.35 -175.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.17 -50.87 71.49 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.366 0.416 . . . . 0.0 110.528 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 98.9 m -57.42 -56.12 25.9 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.809 174.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.62 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 30.7 mtm180 -56.13 -43.49 78.24 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -170.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.465 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 66.4 mtm180 -69.24 -48.48 61.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.591 0.234 . . . . 0.0 111.441 -174.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.462 ' O ' ' HG3' ' A' ' 55' ' ' LYS . . . -64.83 -38.29 90.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.258 0.551 . . . . 0.0 109.787 177.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.607 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 55.3 t80 -48.96 -67.56 0.26 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.735 -1.12 . . . . 0.0 112.393 179.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 49' ' ' ARG . 0.4 OUTLIER -68.11 -29.98 69.03 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -174.523 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.841 ' HE2' HD12 ' A' ' 63' ' ' ILE . 59.0 mttm -59.14 -42.12 89.92 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.112 0.482 . . . . 0.0 110.224 173.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.462 ' HG3' ' O ' ' A' ' 51' ' ' ALA . 28.8 mtpp -74.94 -30.64 61.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.395 -178.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 11.4 mmpt? -64.42 -27.13 68.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.356 0.598 . . . . 0.0 109.966 176.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 127.57 65.92 0.14 Allowed Glycine 0 N--CA 1.443 -0.881 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.182 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.69 ' HG ' ' HB2' ' A' ' 62' ' ' GLU . 11.8 tp -151.23 144.51 24.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.002 0.43 . . . . 0.0 110.511 -178.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.732 ' HA ' HG12 ' A' ' 22' ' ' VAL . 2.7 m -87.94 166.51 14.46 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.97 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.56 ' O ' HG12 ' A' ' 63' ' ' ILE . 4.6 m-20 -50.77 -57.7 7.72 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 122.88 0.472 . . . . 0.0 111.779 178.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.425 ' HA ' ' OD2' ' A' ' 64' ' ' ASP . 7.7 pt-20 -58.52 -27.63 64.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.756 -177.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.699 ' OE1' ' HA ' ' A' ' 24' ' ' PRO . 51.8 mt-10 -79.9 -28.17 39.86 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.854 -178.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.841 HD12 ' HE2' ' A' ' 54' ' ' LYS . 3.2 pt -70.11 -34.15 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 C-N-CA 119.952 -0.699 . . . . 0.0 109.758 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.425 ' OD2' ' HA ' ' A' ' 61' ' ' GLU . 3.0 p30 -77.3 -26.02 51.88 Favored 'General case' 0 C--O 1.21 -0.996 0 C-N-CA 119.532 -0.867 . . . . 0.0 110.223 173.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.857 ' HA ' ' HE2' ' A' ' 65' ' ' MET . 0.3 OUTLIER -56.69 -50.94 70.65 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 119.599 -0.84 . . . . 0.0 108.786 173.318 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.42 -57.68 6.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.456 178.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.62 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 3.6 m-85 -66.13 -38.49 88.28 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -173.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -65.68 -45.75 81.68 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -178.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -77.24 -21.26 54.02 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.258 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 32.5 t -79.6 -14.9 58.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.67 0.271 . . . . 0.0 110.37 176.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 80.37 28.37 48.61 Favored Glycine 0 C--N 1.333 0.368 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.78 176.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.611 HG21 ' HD1' ' A' ' 67' ' ' PHE . 10.2 t -145.52 48.22 1.26 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.107 0.956 . . . . 0.0 110.467 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -91.37 -26.23 19.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.15 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 70.69 -75.91 0.07 Allowed 'General case' 0 N--CA 1.463 0.202 0 O-C-N 124.349 1.031 . . . . 0.0 111.852 177.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -124.78 -93.8 0.49 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.048 0.452 . . . . 0.0 110.773 -176.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 . . . . . 0 C--N 1.326 -0.438 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.012 -177.89 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 18.2 m . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 121.229 0.537 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -84.17 -49.65 8.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.913 -175.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -74.31 -31.13 62.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.877 -178.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.454 ' HZ3' ' CD ' ' B' ' 108' ' ' GLU . 59.8 tttp -55.45 -36.95 67.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.136 0.493 . . . . 0.0 110.155 172.135 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' PHE . . . . . 0.523 ' HE2' HG21 ' A' ' 41' ' ' VAL . 33.4 t80 -69.57 -42.3 74.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.66 -177.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' PHE . . . . . 0.53 ' CD2' ' HZ ' ' A' ' 35' ' ' PHE . 37.8 m-85 -75.92 -38.29 57.85 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -178.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.3 -60.16 2.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.238 -172.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' GLU . . . . . 0.454 ' CD ' ' HZ3' ' B' ' 104' ' ' LYS . 43.5 tt0 -61.09 -49.97 75.17 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -171.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.569 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 72.6 mt -58.5 -33.96 70.4 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.735 0.302 . . . . 0.0 111.429 -176.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' PHE . . . . . 0.683 ' HE2' ' HA ' ' A' ' 32' ' ' ALA . 6.1 t80 -92.02 -5.95 52.01 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.212 -174.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -73.83 -23.68 59.68 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.816 -178.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' SER . . . . . 0.491 ' C ' ' HZ3' ' A' ' 34' ' ' LYS . 48.8 m . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.987 -0.53 . . . . 0.0 109.762 176.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 . . . . . 0 C--O 1.234 0.28 0 CA-C-O 120.717 0.294 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -78.25 56.32 1.67 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.467 0.651 . . . . 0.0 109.885 178.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.0 p -133.13 6.33 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.044 175.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.404 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . 41.3 tp -57.26 109.54 1.81 Allowed Pre-proline 0 C--O 1.233 0.232 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.611 -174.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.437 ' HA ' ' O ' ' A' ' 57' ' ' GLY . 21.5 Cg_exo -67.2 132.42 27.72 Favored 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 123.3 2.666 . . . . 0.0 111.878 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 74.4 mtt180 -119.71 160.79 21.87 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.685 179.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.588 ' HB2' ' HD3' ' A' ' 27' ' ' PRO . 39.4 mt-10 -66.18 -55.05 22.41 Favored Pre-proline 0 CA--C 1.539 0.527 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -174.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.588 ' HD3' ' HB2' ' A' ' 26' ' ' GLU . 86.1 Cg_endo -78.85 -16.87 12.57 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 122.083 1.855 . . . . 0.0 112.72 -175.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.4 tt -65.72 -30.52 71.2 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.239 -175.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.7 mt -64.68 -37.76 80.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.125 0.488 . . . . 0.0 110.082 175.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.411 ' O ' HG11 ' A' ' 33' ' ' VAL . . . -70.81 -39.15 73.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.519 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.6 m -61.13 -39.48 90.2 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 121.024 0.44 . . . . 0.0 110.041 174.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.722 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -66.93 -49.13 66.47 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.436 179.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.411 HG11 ' O ' ' A' ' 30' ' ' ALA . 9.8 p -64.34 -35.22 73.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.615 -178.418 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.526 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.6 tmmm? -59.09 -52.26 66.52 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 172.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.506 ' HZ ' ' CD2' ' B' ' 106' ' ' PHE . 85.9 t80 -50.95 -52.8 38.76 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.571 179.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 39.3 mt -59.63 -40.38 87.44 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.764 -176.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -85.95 32.01 0.61 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -172.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -101.71 28.99 5.18 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.239 0.542 . . . . 0.0 109.683 170.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.3 m 70.56 -66.95 0.26 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 114.711 -1.132 . . . . 0.0 112.339 175.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -57.54 -36.12 71.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.635 -173.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.602 HG13 ' HD3' ' A' ' 49' ' ' ARG . 51.5 t -63.03 -44.62 99.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.406 -176.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.509 ' HD2' ' CG2' ' A' ' 72' ' ' THR . 32.9 mtm180 -67.35 -18.76 65.28 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.007 0.432 . . . . 0.0 110.337 -177.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -96.73 -0.87 47.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.682 178.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.6 m -88.22 153.18 51.17 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.289 175.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -60.97 142.37 97.32 Favored 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 122.547 2.165 . . . . 0.0 112.579 -177.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.4 mt -63.11 -23.58 67.51 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.701 177.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.6 -47.59 73.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.355 174.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 73.7 m -70.49 -59.57 2.77 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.324 174.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.875 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 41.0 mtm180 -52.94 -47.41 68.07 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -171.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.44 ' HG2' ' HE2' ' A' ' 67' ' ' PHE . 80.5 mtm180 -67.38 -52.74 36.39 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 121.156 -0.218 . . . . 0.0 111.46 -174.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.44 -34.68 78.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.148 0.499 . . . . 0.0 110.389 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.615 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 49.8 t80 -54.88 -66.41 0.41 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.143 -0.935 . . . . 0.0 112.339 179.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' A' ' 49' ' ' ARG . 0.5 OUTLIER -68.07 -23.73 64.98 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.713 -173.809 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.576 ' HA ' ' O ' ' A' ' 58' ' ' LEU . 97.4 mttt -63.15 -48.62 77.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.985 0.421 . . . . 0.0 110.683 173.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -67.85 -22.39 65.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.698 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.615 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 11.4 mmpt? -69.78 -45.38 68.13 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.99 176.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.437 ' O ' ' HA ' ' A' ' 24' ' ' PRO . . . 150.79 62.73 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.206 -0.997 . . . . 0.0 113.724 176.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.576 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 3.0 pp -171.89 148.36 2.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.938 0.399 . . . . 0.0 110.75 173.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.622 HG21 ' H ' ' A' ' 60' ' ' ASP . 1.5 m -93.75 177.05 6.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.02 -177.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.661 ' O ' HG12 ' A' ' 63' ' ' ILE . 2.7 m-20 -49.81 -46.03 50.58 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -174.365 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 65' ' ' MET . 8.6 pt-20 -52.15 -40.29 61.2 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.163 0.506 . . . . 0.0 111.356 178.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.56 ' CB ' ' HB2' ' A' ' 58' ' ' LEU . 1.5 mp0 -77.45 -27.03 52.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.354 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.661 HG12 ' O ' ' A' ' 60' ' ' ASP . 2.4 pt -69.53 -39.62 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 120.269 -0.573 . . . . 0.0 110.158 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.54 -26.8 63.73 Favored 'General case' 0 C--O 1.211 -0.956 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 176.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.902 ' HE3' ' HA ' ' A' ' 65' ' ' MET . 19.0 mmt -64.84 -49.9 68.76 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.227 175.272 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.72 -40.86 84.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.169 0.509 . . . . 0.0 110.365 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.875 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.8 m-85 -69.82 -28.56 65.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.194 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.3 tp60 -65.87 -50.06 65.9 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.037 0.446 . . . . 0.0 110.058 176.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -62.62 -36.94 84.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.888 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 32.4 p -83.86 0.23 48.48 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.572 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.91 37.19 94.28 Favored Glycine 0 C--N 1.334 0.433 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.738 177.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.509 ' CG2' ' HD2' ' A' ' 42' ' ' ARG . 35.9 p -125.15 19.33 8.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.074 0.464 . . . . 0.0 111.837 -176.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -77.13 71.45 3.62 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 174.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.66 -72.14 0.06 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.111 -0.95 . . . . 0.0 112.901 -173.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -129.77 -73.46 0.56 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.685 0.279 . . . . 0.0 110.443 -176.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 . . . . . 0 N--CA 1.446 -0.636 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 174.666 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 21.6 m . . . . . 0 N--CA 1.476 0.835 0 CA-C-O 120.761 0.315 . . . . 0.0 110.839 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -85.79 -31.83 22.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.839 0.352 . . . . 0.0 111.061 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -64.89 -34.25 77.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.729 0.3 . . . . 0.0 111.349 -177.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.655 ' HZ1' ' HB2' ' B' ' 104' ' ' LYS . 0.1 OUTLIER -68.91 -18.75 64.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.894 179.609 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -70.78 -35.11 72.42 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.787 0.327 . . . . 0.0 110.228 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' PHE . . . . . 0.506 ' CD2' ' HZ ' ' A' ' 35' ' ' PHE . 12.3 m-85 -79.02 -33.48 44.8 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.526 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' GLN . . . . . 0.573 ' HG2' ' HA ' ' B' ' 104' ' ' LYS . 11.4 pt20 -91.65 -50.15 5.91 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -175.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' B' ' 107' ' ' GLN . 20.5 tt0 -78.58 -28.69 45.91 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 111.628 0.233 . . . . 0.0 111.628 -169.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.526 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 42.2 tp -69.66 -19.3 63.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.08 0.467 . . . . 0.0 110.161 178.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' PHE . . . . . 0.502 ' CE2' ' HA ' ' A' ' 32' ' ' ALA . 2.3 t80 -97.16 -5.2 37.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.855 -179.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -63.33 -52.48 61.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.385 0.612 . . . . 0.0 109.926 177.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 C--O 1.248 0.981 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.606 179.226 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 . . . . . 0 N--CA 1.458 -0.061 0 CA-C-O 121.243 0.544 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.465 ' O ' ' HA3' ' A' ' 57' ' ' GLY . 6.0 t30 -164.64 47.37 0.1 Allowed 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 175.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.6 t -119.26 59.67 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.871 -174.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.478 ' O ' ' HG3' ' A' ' 25' ' ' ARG . 1.0 OUTLIER -99.41 106.86 41.92 Favored Pre-proline 0 C--N 1.322 -0.619 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 176.676 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.518 ' HB3' ' HG2' ' A' ' 62' ' ' GLU . 28.7 Cg_endo -62.72 92.12 0.14 Allowed 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.824 2.349 . . . . 0.0 111.988 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.542 ' HB2' ' HB2' ' A' ' 28' ' ' LEU . 74.6 mtt180 -90.2 147.52 23.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.927 -177.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.46 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 13.2 tp10 -61.97 -53.09 62.99 Favored Pre-proline 0 CA--C 1.539 0.533 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.131 -179.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.46 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 26.8 Cg_endo -64.2 -20.14 66.71 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 121.993 1.796 . . . . 0.0 112.178 178.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.542 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 46.7 tp -67.78 -46.26 72.51 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.838 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 50.7 mm -64.12 -42.05 94.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.168 177.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.42 -43.19 93.1 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.181 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 31.7 m -67.91 -36.56 80.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.617 178.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.498 ' O ' HD12 ' A' ' 36' ' ' LEU . . . -61.7 -40.62 95.65 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.749 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 80.3 t -64.89 -43.21 96.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.807 0.337 . . . . 0.0 110.334 177.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.456 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 5.4 tmtm? -55.87 -45.46 78.51 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.166 174.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.538 ' O ' HG23 ' A' ' 41' ' ' VAL . 78.5 t80 -60.96 -56.92 15.42 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.342 178.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.527 ' HG ' ' HE1' ' A' ' 67' ' ' PHE . 0.6 OUTLIER -51.59 -42.02 61.62 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.342 -176.207 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -92.06 39.62 1.02 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.328 0.585 . . . . 0.0 111.926 -174.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.673 ' HB3' HG22 ' A' ' 41' ' ' VAL . 27.8 t-20 -88.21 6.45 36.67 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 167.165 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.43 ' HB3' ' O ' ' A' ' 38' ' ' ASN . 46.8 t 76.44 -60.74 0.47 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.792 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 77.6 mtt180 -69.15 -16.34 63.62 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -177.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.673 HG22 ' HB3' ' A' ' 38' ' ' ASN . 97.4 t -69.56 -32.41 52.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.854 0.359 . . . . 0.0 111.138 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 66.1 mtp180 -74.57 -33.19 62.63 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.126 177.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -76.75 -32.45 57.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.993 177.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -58.91 132.67 86.86 Favored Pre-proline 0 N--CA 1.45 -0.435 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.454 173.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -43.89 124.69 4.78 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.542 2.828 . . . . 0.0 113.04 -174.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.841 HD21 ' HB3' ' A' ' 75' ' ' ASP . 5.9 mp -69.54 -18.85 63.7 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.298 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -52.06 -42.71 63.36 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 168.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.467 HG22 ' CE2' ' B' ' 106' ' ' PHE . 68.5 m -67.91 -41.26 82.94 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.263 173.078 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.694 ' CG ' ' HA ' ' A' ' 46' ' ' LEU . 13.4 mmp_? -53.07 -45.83 68.32 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.49 -176.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.563 ' O ' ' HE3' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -62.3 -57.62 10.69 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.834 -0.346 . . . . 0.0 111.644 -179.153 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.37 -42.63 96.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.125 0.488 . . . . 0.0 110.888 -178.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -59.48 -50.5 73.68 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.267 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.505 HD22 ' O ' ' A' ' 49' ' ' ARG . 1.8 mm? -60.29 -47.15 87.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.96 0.41 . . . . 0.0 110.622 179.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.801 ' HE2' HD12 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -64.87 -35.29 80.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.509 -178.434 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.41 ' HD3' ' HA ' ' A' ' 55' ' ' LYS . 31.8 mmtm -78.3 -23.28 47.21 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.882 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -75.74 -11.07 59.92 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.605 0.241 . . . . 0.0 111.039 -177.843 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.465 ' HA3' ' O ' ' A' ' 21' ' ' ASN . . . 114.06 25.92 3.99 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.123 -1.036 . . . . 0.0 114.108 170.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.625 ' CD1' HG21 ' A' ' 63' ' ' ILE . 2.3 pp -135.87 139.39 43.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 117.396 0.598 . . . . 0.0 110.459 177.524 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.38 173.04 11.45 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.775 -176.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.668 ' O ' HG12 ' A' ' 63' ' ' ILE . 14.0 m-20 -52.06 -47.49 65.1 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -173.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -61.65 -28.5 69.43 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.369 -178.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.518 ' HG2' ' HB3' ' A' ' 24' ' ' PRO . 4.9 mp0 -74.98 -29.66 60.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.743 -0.208 . . . . 0.0 110.762 176.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.801 HD12 ' HE2' ' A' ' 54' ' ' LYS . 1.7 pt -69.96 -42.48 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 120.246 -0.582 . . . . 0.0 109.47 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.522 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 9.8 m-20 -73.56 -16.13 61.27 Favored 'General case' 0 C--O 1.211 -0.963 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 177.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.401 ' O ' ' HB3' ' A' ' 68' ' ' GLN . 32.4 tpp -73.04 -50.29 23.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.888 0.375 . . . . 0.0 110.441 173.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.06 -39.47 90.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.308 0.575 . . . . 0.0 109.937 178.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.527 ' HE1' ' HG ' ' A' ' 36' ' ' LEU . 10.3 m-85 -72.91 -27.76 62.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.925 176.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.522 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 22.3 tt0 -60.2 -54.65 43.29 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.488 0.661 . . . . 0.0 109.788 174.088 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -65.93 -27.12 67.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.983 -176.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.3 m -84.08 -9.7 58.4 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.017 177.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 68.75 36.85 83.41 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.367 178.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 41.0 p -115.29 86.21 2.41 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.947 0.403 . . . . 0.0 111.337 -176.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -97.79 -9.72 26.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.997 0.427 . . . . 0.0 110.299 175.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.97 127.23 31.26 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.722 176.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.841 ' HB3' HD21 ' A' ' 46' ' ' LEU . 32.8 t0 67.34 93.21 0.08 Allowed 'General case' 0 C--N 1.323 -0.566 0 O-C-N 124.451 1.095 . . . . 0.0 109.376 -172.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.449 -0.494 0 CA-C-N 114.599 -1.182 . . . . 0.0 112.961 -171.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' SER . . . . . 0.454 ' HB2' ' HG3' ' B' ' 104' ' ' LYS . 50.8 m . . . . . 0 N--CA 1.477 0.904 0 CA-C-O 120.646 0.26 . . . . 0.0 111.014 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -68.82 -25.88 64.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.999 0.428 . . . . 0.0 110.082 178.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -52.46 -40.13 61.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.196 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' LYS . . . . . 0.454 ' HG3' ' HB2' ' B' ' 101' ' ' SER . 81.5 mttt -66.98 -33.17 74.98 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.737 -178.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -62.59 -23.2 66.91 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.395 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' PHE . . . . . 0.467 ' CE2' HG22 ' A' ' 48' ' ' THR . 55.6 m-85 -96.22 -51.49 4.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.544 177.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -80.78 -46.71 14.97 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -173.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.77 -49.0 74.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.491 -173.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' LEU . . . . . 0.456 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 89.4 mt -68.99 -9.81 54.25 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -175.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' PHE . . . . . 0.44 ' CE2' ' HA ' ' A' ' 32' ' ' ALA . 5.5 t80 -104.18 -5.9 21.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.109 0.481 . . . . 0.0 110.548 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -76.63 -26.15 54.61 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.966 0.412 . . . . 0.0 110.587 -175.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 64.9 m . . . . . 0 C--O 1.247 0.968 0 CA-C-O 118.603 -0.713 . . . . 0.0 110.131 176.095 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 C--O 1.234 0.31 0 CA-C-O 121.163 0.401 . . . . 0.0 112.269 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.467 ' HB3' ' HG2' ' A' ' 27' ' ' PRO . 92.5 mtt180 -135.88 139.09 43.1 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.778 -175.497 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.603 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 36.3 tt0 -61.36 -41.2 78.33 Favored Pre-proline 0 CA--C 1.54 0.57 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.275 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.603 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 5.0 Cg_endo -50.88 -30.74 31.21 Favored 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 122.061 1.84 . . . . 0.0 112.412 173.103 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 99.7 mt -68.5 -44.52 74.52 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 43.7 mm -58.62 -49.1 83.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.2 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.92 -47.37 83.03 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.14 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 32.1 m -64.34 -36.01 82.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.886 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.78 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -69.11 -49.51 56.48 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.401 -178.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 90.9 t -57.44 -42.24 80.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-O 120.751 0.31 . . . . 0.0 110.458 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.549 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.7 tmmm? -58.42 -48.11 81.76 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.995 174.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.629 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 80.1 t80 -56.7 -54.86 41.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.7 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.78 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 32.9 mt -58.05 -54.51 46.17 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.533 -174.664 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -93.59 20.31 7.53 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.656 -173.305 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -66.87 -53.9 27.69 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 174.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.2 p -172.48 -69.32 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.174 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -91.07 -21.54 21.18 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -167.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.506 ' HB ' ' HA ' ' A' ' 36' ' ' LEU . 40.1 t -67.29 -33.27 61.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.728 -173.248 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.546 ' HG2' ' O ' ' A' ' 36' ' ' LEU . 13.1 mmm180 -62.99 -28.49 70.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.019 0.437 . . . . 0.0 110.357 175.497 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -95.57 -6.32 40.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.976 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.2 t -80.11 136.78 53.48 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.012 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_exo -57.92 143.3 96.21 Favored 'Trans proline' 0 C--O 1.237 0.428 0 C-N-CA 122.963 2.442 . . . . 0.0 111.96 178.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.551 HD21 HH21 ' A' ' 49' ' ' ARG . 0.9 OUTLIER -68.72 -19.51 64.36 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.206 -176.953 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -53.29 -42.29 66.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.743 0.306 . . . . 0.0 110.337 172.352 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 84.7 m -71.22 -53.04 15.76 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.48 172.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.551 HH21 HD21 ' A' ' 46' ' ' LEU . 15.6 mtm180 -60.18 -34.2 73.27 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -169.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.469 ' HA ' HD11 ' A' ' 63' ' ' ILE . 6.1 mpp_? -67.67 -56.77 8.06 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 121.263 -0.175 . . . . 0.0 111.332 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.449 ' O ' ' HG3' ' A' ' 55' ' ' LYS . . . -59.7 -43.29 94.15 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 177.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.811 ' HD1' HD12 ' A' ' 53' ' ' LEU . 79.6 t80 -50.66 -66.92 0.3 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.414 -178.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.811 HD12 ' HD1' ' A' ' 52' ' ' PHE . 8.2 mp -60.32 -40.03 89.16 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.729 0.299 . . . . 0.0 111.292 -175.589 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 58' ' ' LEU . 60.1 mttm -63.24 -37.76 88.49 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.225 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 51' ' ' ALA . 29.6 mtpp -78.64 -27.62 45.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.47 179.127 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.948 ' HE2' ' HA ' ' A' ' 56' ' ' LYS . 9.3 mmpt? -69.75 -25.29 63.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.205 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 135.65 2.54 2.84 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.157 -1.02 . . . . 0.0 113.02 177.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.541 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 5.8 mp -92.45 126.69 37.64 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.865 0.364 . . . . 0.0 110.459 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.2 p -70.4 173.63 6.66 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 116.244 -0.435 . . . . 0.0 109.952 174.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.613 ' O ' HG22 ' A' ' 63' ' ' ILE . 3.3 m-20 -56.25 -45.07 80.2 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.263 0.554 . . . . 0.0 110.392 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.455 ' O ' ' HG2' ' A' ' 65' ' ' MET . 10.3 pt-20 -56.3 -42.43 77.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.065 177.069 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -72.29 -33.59 67.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.424 -174.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.728 HG13 HD22 ' A' ' 53' ' ' LEU . 17.4 tt -69.71 -36.27 69.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 120.001 -0.679 . . . . 0.0 110.816 -177.093 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.66 -28.13 58.62 Favored 'General case' 0 C--O 1.211 -0.969 0 C-N-CA 119.072 -1.051 . . . . 0.0 109.316 173.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.476 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 21.9 mmt -59.45 -51.88 68.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.806 0.336 . . . . 0.0 110.246 175.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.94 -42.29 99.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.074 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.529 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 6.8 m-85 -73.13 -29.05 62.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.941 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -71.48 -40.45 70.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.217 0.532 . . . . 0.0 109.8 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.454 ' HG2' ' O ' ' A' ' 65' ' ' MET . 14.5 mm100 -69.95 -39.99 75.72 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.113 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 27.1 p -78.11 -24.28 47.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.022 0.439 . . . . 0.0 110.857 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 73.43 70.36 1.25 Allowed Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 121.091 -0.576 . . . . 0.0 113.151 174.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.0 p . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 110.218 -0.289 . . . . 0.0 110.218 174.834 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 78.2 tttt . . . . . 0 N--CA 1.457 -0.123 0 CA-C-O 120.804 0.335 . . . . 0.0 110.407 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -62.52 -32.52 73.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.523 178.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 106' ' ' PHE . . . . . 0.629 ' HD2' ' HZ ' ' A' ' 35' ' ' PHE . 62.1 m-85 -76.99 -26.67 54.15 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.435 0.636 . . . . 0.0 110.141 178.026 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -91.55 -61.44 1.64 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.841 -172.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -60.25 -45.83 91.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.614 -175.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.549 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 34.6 tp -68.22 -30.92 70.09 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.532 -174.123 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 110' ' ' PHE . . . . . 0.612 ' HE2' ' HA ' ' A' ' 32' ' ' ALA . 8.5 t80 -92.45 -16.57 25.69 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.803 -177.406 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -59.37 -43.92 92.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.228 0.537 . . . . 0.0 110.051 176.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 37.6 m . . . . . 0 C--O 1.251 1.159 0 CA-C-N 115.219 -0.901 . . . . 0.0 109.538 177.698 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.802 ' HB2' ' HG3' ' A' ' 62' ' ' GLU . 96.5 Cg_endo . . . . . 0 N--CA 1.45 -1.04 0 CA-C-O 121.016 0.34 . . . . 0.0 112.411 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 66.8 mtm180 -134.01 169.8 16.58 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.979 179.558 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.551 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 8.8 tp10 -53.87 -50.9 81.3 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -176.252 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.551 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 10.2 Cg_endo -52.48 -28.26 35.25 Favored 'Trans proline' 0 C--N 1.36 1.154 0 C-N-CA 122.745 2.297 . . . . 0.0 113.359 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 57' ' ' GLY . 4.4 mm? -68.59 -44.78 73.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.781 0.324 . . . . 0.0 110.519 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.442 ' O ' HG23 ' A' ' 33' ' ' VAL . 46.2 mm -60.89 -49.89 82.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.479 -179.566 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.13 -47.69 80.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.502 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 28.1 m -65.99 -37.61 86.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.742 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.8 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -67.24 -48.51 67.58 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.042 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.452 HG13 ' HB3' ' A' ' 70' ' ' SER . 84.3 t -58.76 -42.58 85.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-O 120.552 0.215 . . . . 0.0 110.826 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.504 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.6 tmmm? -55.75 -46.01 77.94 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.274 0.559 . . . . 0.0 109.918 174.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.506 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 73.9 t80 -61.53 -52.61 63.75 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.718 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.954 ' HA ' HG11 ' A' ' 41' ' ' VAL . 54.5 mt -57.92 -37.57 74.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.042 -173.245 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -96.96 34.5 1.71 Allowed 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 120.836 0.351 . . . . 0.0 111.576 -177.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -94.06 28.69 2.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.157 0.503 . . . . 0.0 110.15 175.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.2 t 69.04 -67.47 0.21 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.704 176.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -64.92 -22.86 67.07 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.28 -175.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.954 HG11 ' HA ' ' A' ' 36' ' ' LEU . 40.9 t -68.73 -33.1 57.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -178.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -80.7 -18.26 48.46 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.044 0.449 . . . . 0.0 110.628 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -86.82 -35.34 19.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.323 0.582 . . . . 0.0 109.459 173.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.492 ' CB ' HH12 ' A' ' 49' ' ' ARG . 43.2 t -65.26 133.45 95.52 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.224 176.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -42.91 128.37 5.19 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 124.206 3.271 . . . . 0.0 114.272 -174.184 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.533 ' H ' HD12 ' A' ' 46' ' ' LEU . 4.6 mp -64.57 -20.24 66.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.948 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -55.39 -44.17 75.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.435 173.563 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.1 m -67.14 -40.92 86.8 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.822 174.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.538 ' HB3' ' CZ ' ' A' ' 67' ' ' PHE . 16.9 mmp_? -52.59 -48.84 66.01 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.525 -174.408 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -58.68 -61.41 2.63 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.642 0.258 . . . . 0.0 111.633 -176.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.08 -42.12 97.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.782 -178.434 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.707 ' HD1' HD12 ' A' ' 53' ' ' LEU . 58.4 t80 -51.78 -58.22 7.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.258 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.822 HD22 HG13 ' A' ' 63' ' ' ILE . 8.0 mp -60.58 -44.89 95.69 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 121.049 -0.26 . . . . 0.0 111.221 -177.372 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -67.46 -30.9 70.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.044 0.45 . . . . 0.0 111.544 -175.072 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.8 mmtm -78.54 -22.92 46.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.537 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.437 ' HD2' ' O ' ' A' ' 52' ' ' PHE . 1.0 OUTLIER -74.46 -41.31 61.0 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.587 175.733 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.525 ' O ' ' HG ' ' A' ' 28' ' ' LEU . . . 148.2 69.66 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.178 -1.011 . . . . 0.0 113.532 175.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.676 HD11 ' HB3' ' A' ' 53' ' ' LEU . 3.5 pp -166.1 150.82 8.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.854 0.359 . . . . 0.0 110.452 174.508 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.4 p -90.35 178.17 6.2 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.775 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.466 ' HA ' HG22 ' A' ' 63' ' ' ILE . 1.0 OUTLIER -55.23 -40.09 70.46 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -178.567 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -64.48 -35.64 81.59 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.001 0.429 . . . . 0.0 110.867 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.802 ' HG3' ' HB2' ' A' ' 24' ' ' PRO . 15.0 mm-40 -79.72 -29.1 40.56 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -177.096 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.822 HG13 HD22 ' A' ' 53' ' ' LEU . 11.6 tt -70.26 -37.06 70.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.043 -0.663 . . . . 0.0 111.083 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -77.47 -19.12 56.43 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 119.088 -1.045 . . . . 0.0 110.16 171.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.655 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 0.7 OUTLIER -61.82 -46.15 90.73 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 171.874 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.83 -46.37 45.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.536 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.582 ' CD1' HD13 ' A' ' 36' ' ' LEU . 0.9 OUTLIER -71.06 -41.64 70.47 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -176.814 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -67.73 -42.57 81.66 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.966 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -61.22 -39.73 91.37 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.901 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.452 ' HB3' HG13 ' A' ' 33' ' ' VAL . 25.0 p -74.7 -6.93 51.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.869 0.366 . . . . 0.0 111.225 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 84.44 8.34 83.42 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 121.01 -0.614 . . . . 0.0 111.899 178.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.2 m . . . . . 0 C--N 1.323 -0.585 0 CA-C-O 120.889 0.376 . . . . 0.0 110.731 -177.2 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 62.6 tttp . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 121.16 0.505 . . . . 0.0 110.134 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -59.85 -35.55 75.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.348 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 106' ' ' PHE . . . . . 0.534 ' HB3' ' CE2' ' A' ' 52' ' ' PHE . 20.1 m-85 -77.13 -24.77 51.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.227 179.294 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -93.94 -59.12 2.05 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.784 -174.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.3 -30.73 71.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.816 -171.058 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.504 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 87.6 mt -77.17 -29.54 54.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.705 0.288 . . . . 0.0 111.063 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 110' ' ' PHE . . . . . 0.424 ' CD1' ' HG2' ' A' ' 56' ' ' LYS . 1.1 t80 -90.19 -6.31 55.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.226 0.536 . . . . 0.0 110.19 -178.663 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -62.26 -52.5 63.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.409 177.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.249 1.051 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.502 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo . . . . . 0 N--CA 1.459 -0.511 0 CA-C-O 120.717 0.215 . . . . 0.0 112.258 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -134.03 142.61 47.67 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.231 0.538 . . . . 0.0 112.134 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.511 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 15.4 tp10 -55.16 -52.36 71.9 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 114.765 -1.107 . . . . 0.0 112.556 177.441 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 10.6 Cg_endo -55.43 -35.17 91.47 Favored 'Trans proline' 0 C--N 1.358 1.071 0 C-N-CA 122.371 2.047 . . . . 0.0 112.768 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 57' ' ' GLY . 0.6 OUTLIER -64.67 -44.18 91.2 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -178.538 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.1 mt -58.62 -42.97 86.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.484 178.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.04 -44.58 97.19 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.308 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.3 m -69.02 -35.24 76.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.859 178.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.565 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -62.35 -45.12 94.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.195 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.7 t -67.5 -36.66 77.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.708 0.29 . . . . 0.0 110.38 178.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.58 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.5 tmtm? -56.8 -52.38 65.29 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.209 0.528 . . . . 0.0 109.594 173.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.524 ' O ' HG21 ' A' ' 41' ' ' VAL . 85.6 t80 -56.11 -51.96 66.02 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.043 177.28 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.565 HD13 ' O ' ' A' ' 32' ' ' ALA . 2.8 mp -52.08 -58.25 7.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.4 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -92.58 43.21 1.12 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.294 0.569 . . . . 0.0 111.828 -173.414 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -75.83 -56.62 4.5 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 167.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.8 p 173.16 -64.75 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.402 176.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.425 ' HE ' ' HB2' ' A' ' 40' ' ' ARG . 15.3 ttm180 -80.22 -25.73 39.48 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.728 -170.072 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.524 HG21 ' O ' ' A' ' 35' ' ' PHE . 74.0 t -58.13 -38.57 68.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -171.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.7 mtm180 -74.88 -11.83 60.22 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.921 0.391 . . . . 0.0 110.851 -177.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -106.69 2.16 25.6 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.111 0.482 . . . . 0.0 110.198 177.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 41.5 m -85.07 144.02 40.69 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.722 177.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -49.94 122.13 8.59 Favored 'Trans proline' 0 C--O 1.237 0.472 0 C-N-CA 122.964 2.443 . . . . 0.0 112.555 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.685 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 37.0 mt -62.55 -20.09 64.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.312 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -49.58 -49.09 47.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.835 0.35 . . . . 0.0 110.674 172.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.502 HG21 ' CZ ' ' B' ' 106' ' ' PHE . 63.6 m -70.42 -42.91 70.97 Favored 'General case' 0 C--O 1.22 -0.485 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 173.138 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.671 ' HB2' ' HA ' ' A' ' 46' ' ' LEU . 0.8 OUTLIER -53.34 -44.98 68.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.389 -174.212 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.685 ' HG2' ' O ' ' A' ' 46' ' ' LEU . 30.3 mmt180 -64.23 -61.69 2.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.827 0.346 . . . . 0.0 110.313 -177.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.98 -33.37 71.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.808 -177.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.68 ' HD1' HD12 ' A' ' 53' ' ' LEU . 72.4 t80 -54.69 -56.19 21.77 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.707 -0.678 . . . . 0.0 111.605 179.308 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.68 HD12 ' HD1' ' A' ' 52' ' ' PHE . 9.7 mp -63.66 -39.11 93.51 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.83 -0.348 . . . . 0.0 111.056 -178.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.717 ' HE2' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -66.77 -38.24 86.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.885 0.374 . . . . 0.0 111.646 -179.572 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.568 ' NZ ' ' HA ' ' A' ' 55' ' ' LYS . 0.8 OUTLIER -79.87 -30.02 40.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 179.606 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.66 ' HE2' ' HA ' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -70.75 -28.67 64.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.03 0.443 . . . . 0.0 110.599 -176.416 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.585 ' O ' ' HG ' ' A' ' 28' ' ' LEU . . . 128.86 64.78 0.11 Allowed Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.213 177.704 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.561 HD13 HD12 ' A' ' 28' ' ' LEU . 15.2 tp -160.6 155.65 24.44 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 -178.28 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.568 ' O ' HG23 ' A' ' 63' ' ' ILE . 4.5 p -95.4 163.34 13.28 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.014 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.787 ' O ' HG12 ' A' ' 63' ' ' ILE . 4.9 m-20 -55.66 -37.99 68.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.679 0.276 . . . . 0.0 111.33 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -52.52 -52.13 56.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.95 0.405 . . . . 0.0 111.514 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.436 ' HB2' ' HG ' ' A' ' 58' ' ' LEU . 8.8 mp0 -72.49 -25.34 61.38 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.423 -176.086 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.787 HG12 ' O ' ' A' ' 60' ' ' ASP . 8.1 pt -64.12 -38.85 83.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 C-N-CA 119.695 -0.802 . . . . 0.0 110.718 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.11 -30.84 63.93 Favored 'General case' 0 C--O 1.206 -1.204 0 C-N-CA 119.361 -0.936 . . . . 0.0 109.001 173.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.424 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 2.4 tpt -59.01 -45.17 91.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.088 0.471 . . . . 0.0 109.967 177.721 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.31 -48.96 54.26 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.147 177.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.468 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.3 m-85 -65.73 -32.35 73.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.841 -178.075 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -67.93 -44.53 76.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.441 0.639 . . . . 0.0 109.548 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -70.95 -28.83 64.77 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.668 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.9 t -73.15 -15.23 61.47 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.571 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.96 -4.65 75.24 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.09 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 18.4 p . . . . . 0 C--N 1.325 -0.458 0 CA-C-O 121.364 0.602 . . . . 0.0 111.197 -177.957 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? . . . . . 0 CA--C 1.531 0.215 0 CA-C-O 120.954 0.407 . . . . 0.0 110.723 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 105' ' ' PHE . . . . . 0.469 ' O ' ' HE1' ' A' ' 35' ' ' PHE . 82.5 t80 -66.4 -27.66 68.02 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.785 -178.396 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 106' ' ' PHE . . . . . 0.582 ' HB3' ' CE2' ' A' ' 52' ' ' PHE . 65.1 m-85 -88.97 -33.99 17.02 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.95 0.405 . . . . 0.0 111.332 -177.643 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -89.45 -43.9 10.53 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -173.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -68.98 -44.75 72.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.787 0.327 . . . . 0.0 111.061 -175.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.58 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 8.8 mp -72.65 -4.57 31.84 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.474 -176.43 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 110' ' ' PHE . . . . . 0.503 ' CE1' ' HG2' ' A' ' 56' ' ' LYS . 4.5 t80 -104.68 -4.09 22.88 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.926 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -61.58 -64.3 0.99 Allowed 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.378 -177.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 3.0 p . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.75 -0.643 . . . . 0.0 110.906 -179.644 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo . . . . . 0 C--O 1.235 0.352 0 CA-C-O 121.068 0.362 . . . . 0.0 112.911 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.589 ' HB2' HD23 ' A' ' 28' ' ' LEU . 61.6 mtp180 -137.19 128.75 28.51 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.495 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.634 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 32.0 mt-10 -56.92 -35.75 39.06 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -176.391 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.634 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 4.3 Cg_endo -49.64 -29.76 20.25 Favored 'Trans proline' 0 C--N 1.358 1.079 0 C-N-CA 122.197 1.931 . . . . 0.0 112.996 172.598 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.589 HD23 ' HB2' ' A' ' 25' ' ' ARG . 4.3 mm? -66.08 -30.97 71.57 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.758 0.313 . . . . 0.0 110.764 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.415 ' O ' HG23 ' A' ' 33' ' ' VAL . 44.9 mm -62.39 -42.95 97.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.868 177.084 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.3 -46.27 84.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.15 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.6 m -61.73 -41.73 98.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.934 0.397 . . . . 0.0 110.483 177.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.548 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -63.59 -45.3 91.01 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.77 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.443 HG13 HE21 ' A' ' 37' ' ' GLN . 72.3 t -63.88 -39.97 87.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.664 0.269 . . . . 0.0 110.764 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.437 ' HE2' ' O ' ' B' ' 109' ' ' LEU . 0.8 OUTLIER -55.83 -50.5 70.37 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.199 0.524 . . . . 0.0 110.219 174.754 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.424 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 84.4 t80 -59.82 -56.25 24.06 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.638 178.531 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.548 HD13 ' O ' ' A' ' 32' ' ' ALA . 1.8 mp -50.78 -57.74 7.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.985 -1.007 . . . . 0.0 112.565 -177.088 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.443 HE21 HG13 ' A' ' 33' ' ' VAL . 35.3 mt-30 -95.28 32.64 1.7 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.641 -171.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -70.1 -63.08 1.15 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 173.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.8 p -167.57 -68.17 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.513 -178.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -96.62 -15.25 21.63 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -171.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.465 ' HB ' ' O ' ' A' ' 36' ' ' LEU . 85.6 t -59.78 -43.44 91.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 112.81 0.671 . . . . 0.0 112.81 -171.526 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.424 ' HD3' ' HG2' ' A' ' 37' ' ' GLN . 60.1 mtm180 -68.07 -19.03 64.83 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.126 -178.128 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -92.86 -15.92 25.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.253 0.549 . . . . 0.0 110.456 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 31.0 m -72.24 152.41 92.36 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.119 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -43.31 124.99 4.26 Favored 'Trans proline' 0 C--O 1.237 0.44 0 C-N-CA 123.731 2.954 . . . . 0.0 113.012 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.619 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 5.7 mp -69.28 -33.06 72.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.284 -178.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -55.76 -43.93 77.18 Favored 'General case' 0 C--O 1.234 0.24 0 O-C-N 123.444 0.465 . . . . 0.0 110.632 176.155 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.514 HG21 ' CZ ' ' B' ' 106' ' ' PHE . 99.9 m -55.97 -52.41 64.27 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.146 173.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.685 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 61.6 mtm180 -65.28 -21.49 66.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.487 -175.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.619 ' HG2' ' O ' ' A' ' 46' ' ' LEU . 32.5 mmt180 -66.56 -61.0 2.21 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 175.324 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.416 ' O ' ' HG2' ' A' ' 55' ' ' LYS . . . -59.87 -42.94 94.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.022 177.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.674 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 80.2 t80 -49.48 -61.08 2.3 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.985 178.002 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.776 ' HG ' HG13 ' A' ' 63' ' ' ILE . 2.8 mm? -53.12 -42.63 66.21 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -177.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.489 ' HD3' ' O ' ' A' ' 50' ' ' ARG . 1.7 mptm? -67.46 -36.82 81.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.858 0.361 . . . . 0.0 111.136 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 51' ' ' ALA . 13.7 mmmm -78.2 -23.51 47.5 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.143 -0.481 . . . . 0.0 112.078 -177.702 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.674 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 19.7 mmmt -79.64 -29.11 40.9 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.922 -178.062 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 128.39 37.98 0.39 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.84 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.7 mp -130.12 132.45 46.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.829 0.347 . . . . 0.0 110.35 177.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 20.8 p -79.03 176.94 9.19 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.604 176.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.479 ' HA ' HG22 ' A' ' 63' ' ' ILE . 8.4 m-20 -59.59 -38.53 81.45 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 -174.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.451 ' HG3' ' HG3' ' A' ' 62' ' ' GLU . 8.5 pt-20 -65.42 -33.33 75.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.262 0.553 . . . . 0.0 110.792 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.451 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 45.3 mt-10 -79.87 -37.03 35.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.627 -176.769 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.776 HG13 ' HG ' ' A' ' 53' ' ' LEU . 4.6 tt -64.08 -42.74 96.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.953 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.686 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 4.2 p30 -77.98 -19.43 54.5 Favored 'General case' 0 C--O 1.205 -1.274 0 C-N-CA 118.684 -1.207 . . . . 0.0 110.649 174.649 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.634 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 0.5 OUTLIER -61.91 -47.33 85.43 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.674 173.935 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.94 -41.12 64.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.921 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.685 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.1 m-85 -73.03 -31.64 64.57 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -178.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.686 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 4.2 tp-100 -67.0 -47.81 70.36 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -70.32 -31.27 68.51 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.755 -177.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 12.5 p -73.86 -9.14 58.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.747 0.308 . . . . 0.0 111.269 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 84.46 27.27 36.48 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.917 -0.659 . . . . 0.0 113.404 173.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 69.7 p . . . . . 0 C--N 1.323 -0.548 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 177.842 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 61.0 tttm . . . . . 0 CA--C 1.529 0.158 0 CA-C-O 121.06 0.457 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -73.07 -34.91 66.53 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.443 -179.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 106' ' ' PHE . . . . . 0.514 ' CZ ' HG21 ' A' ' 48' ' ' THR . 24.7 m-85 -80.37 -20.73 43.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.762 -175.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -98.16 -62.73 1.2 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.701 0.286 . . . . 0.0 111.375 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -64.38 -36.02 82.79 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -170.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.437 ' O ' ' HE2' ' A' ' 34' ' ' LYS . 0.5 OUTLIER -79.99 -4.85 54.3 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.872 0.367 . . . . 0.0 110.887 -173.93 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 110' ' ' PHE . . . . . 0.566 ' CE1' ' HB3' ' A' ' 56' ' ' LYS . 12.9 t80 -100.34 -4.66 28.71 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.847 0.356 . . . . 0.0 110.721 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -56.68 -52.15 66.03 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.861 -178.063 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 7.4 t . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.121 -0.942 . . . . 0.0 109.221 -178.804 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo . . . . . 0 C--O 1.233 0.225 0 CA-C-O 121.373 0.489 . . . . 0.0 111.711 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.451 HH21 HD22 ' A' ' 28' ' ' LEU . 88.4 mtm180 -105.06 133.72 49.37 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.621 -176.01 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.541 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 38.8 mt-10 -65.34 -45.21 70.11 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.078 -0.965 . . . . 0.0 112.297 -177.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 19.5 Cg_endo -62.69 -22.97 74.46 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 121.923 1.749 . . . . 0.0 112.268 175.355 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.451 HD22 HH21 ' A' ' 25' ' ' ARG . 38.8 tp -71.71 -33.11 68.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.9 178.891 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.526 ' O ' HG23 ' A' ' 33' ' ' VAL . 66.1 mt -62.19 -45.43 98.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 174.534 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.63 -29.37 70.62 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.651 177.186 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.439 ' HB ' ' O ' ' A' ' 28' ' ' LEU . 55.3 m -66.6 -43.55 84.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.464 174.328 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.562 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -62.41 -44.57 96.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.578 178.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 29' ' ' ILE . 40.3 t -61.46 -43.66 97.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.321 178.488 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.429 ' HE2' ' HB3' ' A' ' 34' ' ' LYS . 3.3 tmmm? -53.27 -51.4 62.39 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.333 0.587 . . . . 0.0 110.359 174.666 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.422 ' CD2' HG11 ' A' ' 41' ' ' VAL . 85.4 t80 -55.76 -52.12 65.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.422 178.56 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.605 HD21 ' CD1' ' A' ' 67' ' ' PHE . 5.4 mp -58.01 -51.72 68.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.188 -0.915 . . . . 0.0 113.159 -176.246 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -79.93 34.54 0.29 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -167.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -100.79 29.26 4.64 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 168.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.0 m 72.31 -65.85 0.33 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 114.624 -1.171 . . . . 0.0 112.078 176.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.8 mtp180 -57.0 -44.27 82.58 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -175.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.452 ' CG1' ' HA ' ' A' ' 36' ' ' LEU . 47.3 t -62.0 -39.29 83.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.844 -174.272 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 36' ' ' LEU . 55.7 mtm180 -70.37 -13.01 61.96 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.932 -178.408 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.2 mm-40 -115.59 8.74 15.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.36 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 97.5 p -87.39 154.92 54.34 Favored Pre-proline 0 C--N 1.329 -0.294 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -49.18 116.58 2.31 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.869 2.38 . . . . 0.0 113.027 -178.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.506 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 23.2 mt -58.14 -27.9 64.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.343 177.481 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.82 -42.45 71.91 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.94 0.4 . . . . 0.0 110.812 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 99.7 m -70.41 -49.82 44.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.216 175.593 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.826 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 61.0 mtm180 -62.23 -26.42 68.36 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.514 -173.115 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.55 ' NH1' HD11 ' A' ' 63' ' ' ILE . 22.6 mmm180 -61.21 -61.96 2.19 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.932 0.396 . . . . 0.0 110.61 176.11 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.71 -32.2 73.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.201 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.67 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 91.6 t80 -54.93 -55.81 26.53 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.862 177.363 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.926 HD12 ' HB ' ' A' ' 63' ' ' ILE . 19.6 mt -59.55 -44.67 93.17 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.077 0.236 . . . . 0.0 111.026 -177.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 1.109 ' HE2' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -58.51 -44.44 89.47 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.94 0.4 . . . . 0.0 111.032 -179.577 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.443 ' HA ' ' HD3' ' A' ' 55' ' ' LYS . 31.4 mmtp -70.35 -21.38 62.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.584 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.909 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -73.29 -21.63 60.55 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 121.07 -0.252 . . . . 0.0 111.109 179.07 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.05 32.67 1.49 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.399 -0.905 . . . . 0.0 114.211 173.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.765 HD11 ' HB3' ' A' ' 53' ' ' LEU . 1.4 pp -139.37 142.53 37.55 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 117.479 0.639 . . . . 0.0 110.711 175.419 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.433 ' O ' HG23 ' A' ' 63' ' ' ILE . 1.1 p -70.19 161.89 29.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.828 -0.624 . . . . 0.0 112.524 -172.242 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.592 ' O ' HG12 ' A' ' 63' ' ' ILE . 6.3 t70 -50.04 -49.13 52.11 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.093 0.557 . . . . 0.0 111.57 -174.861 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.496 ' HG3' ' HG2' ' A' ' 62' ' ' GLU . 9.4 pt-20 -53.01 -38.69 62.55 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.677 178.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.496 ' HG2' ' HG3' ' A' ' 61' ' ' GLU . 4.7 mm-40 -78.41 -26.51 46.44 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.752 -175.604 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 1.109 HD13 ' HE2' ' A' ' 54' ' ' LYS . 1.7 pt -67.4 -38.66 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.872 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.663 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 0.3 OUTLIER -75.33 -27.99 59.46 Favored 'General case' 0 C--O 1.212 -0.871 0 C-N-CA 119.801 -0.76 . . . . 0.0 109.246 177.539 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.468 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 2.0 tpt -61.26 -48.49 81.17 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 176.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.62 -47.22 73.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.911 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.826 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 1.4 m-85 -64.62 -37.46 87.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.593 -179.67 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.663 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 16.6 tm0? -60.62 -53.92 51.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.749 0.785 . . . . 0.0 109.237 177.427 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -62.35 -35.09 78.05 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 113.982 -1.463 . . . . 0.0 111.805 -175.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 24.2 m -82.15 -5.33 58.38 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -176.184 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.74 61.48 6.16 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.054 -0.593 . . . . 0.0 111.777 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 39.9 p . . . . . 0 C--N 1.323 -0.555 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -172.454 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 34.6 mttp . . . . . 0 CA--C 1.52 -0.202 0 CA-C-O 121.013 0.435 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -76.54 -22.26 54.6 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 120.739 -0.385 . . . . 0.0 111.053 -178.514 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 106' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -96.55 -32.1 12.43 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 119.798 -0.761 . . . . 0.0 111.477 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -98.36 -48.77 4.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.88 0.372 . . . . 0.0 111.859 -177.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -80.88 -32.0 35.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.445 -172.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.419 HD13 ' O ' ' B' ' 109' ' ' LEU . 1.9 tm? -58.77 -31.53 68.46 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.133 0.492 . . . . 0.0 109.855 179.076 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 110' ' ' PHE . . . . . 0.552 ' CD1' ' HD3' ' A' ' 56' ' ' LYS . 53.5 t80 -64.81 -53.91 39.4 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.829 -178.467 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -50.08 -65.77 0.51 Allowed 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.414 0.446 . . . . 0.0 111.707 -173.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 26.8 m . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.852 -0.594 . . . . 0.0 110.511 -178.658 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo . . . . . 0 C--O 1.234 0.285 0 CA-C-O 121.308 0.461 . . . . 0.0 111.824 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.445 ' O ' HG13 ' A' ' 29' ' ' ILE . 99.2 mtt180 -127.35 165.17 20.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.836 -176.373 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.638 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 44.0 mt-10 -75.94 -42.07 3.51 Favored Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -175.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.638 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 4.9 Cg_endo -48.31 -43.93 30.65 Favored 'Trans proline' 0 C--N 1.358 1.058 0 C-N-CA 122.734 2.289 . . . . 0.0 113.513 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.564 HD12 ' N ' ' A' ' 29' ' ' ILE . 2.3 pp -77.05 -25.96 53.07 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.529 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.564 ' N ' HD12 ' A' ' 28' ' ' LEU . 82.9 mt -65.84 -49.07 79.62 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 N-CA-C 109.389 -0.596 . . . . 0.0 109.389 174.107 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.44 -40.08 81.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.508 177.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 34.5 m -64.85 -40.78 95.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.612 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.435 ' O ' HD23 ' A' ' 36' ' ' LEU . . . -67.0 -39.36 87.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.242 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 29' ' ' ILE . 90.8 t -62.58 -49.12 85.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.693 -0.231 . . . . 0.0 110.878 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.524 ' HD2' ' N ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -67.71 -32.75 73.6 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.028 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.529 ' CE2' HG11 ' A' ' 41' ' ' VAL . 89.7 t80 -59.15 -53.35 59.3 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.078 177.61 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.729 HD13 HG12 ' A' ' 41' ' ' VAL . 3.4 mm? -58.79 -49.05 79.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.277 -178.204 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -92.17 6.89 44.95 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -172.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.413 ' HB2' ' O ' ' A' ' 34' ' ' LYS . 5.0 t30 -60.67 -45.73 93.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.639 0.257 . . . . 0.0 110.778 -177.638 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.573 ' HB2' ' HZ ' ' B' ' 105' ' ' PHE . 14.7 m -156.5 -67.05 0.11 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.865 0.365 . . . . 0.0 111.294 -176.763 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.462 ' HA ' ' NE2' ' A' ' 43' ' ' GLN . 5.3 ptp180 -132.46 -8.83 3.28 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -170.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.729 HG12 HD13 ' A' ' 36' ' ' LEU . 58.3 t -57.51 -40.27 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -172.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.762 ' HG3' HG22 ' A' ' 72' ' ' THR . 33.8 ttp180 -66.08 -21.0 66.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.834 0.349 . . . . 0.0 110.326 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.462 ' NE2' ' HA ' ' A' ' 40' ' ' ARG . 0.5 OUTLIER -97.74 -5.46 34.99 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.488 176.332 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.2 m -83.06 156.59 66.87 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.021 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -45.47 126.2 8.28 Favored 'Trans proline' 0 C--O 1.241 0.645 0 C-N-CA 123.8 3.0 . . . . 0.0 113.665 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.632 ' HG ' ' NH2' ' A' ' 49' ' ' ARG . 6.1 mp -66.66 -24.13 66.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.556 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.46 -44.68 85.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.665 176.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.415 HG21 ' CZ ' ' B' ' 106' ' ' PHE . 84.8 m -64.6 -50.34 67.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.318 176.229 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.73 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 15.6 mtm180 -65.4 -31.36 72.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.215 -172.257 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.409 ' HA ' HD11 ' A' ' 63' ' ' ILE . 1.1 mtt-85 -66.4 -52.54 45.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.708 0.29 . . . . 0.0 111.045 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.7 -40.18 96.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.052 0.453 . . . . 0.0 109.958 176.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.801 ' HD1' HD12 ' A' ' 53' ' ' LEU . 77.0 t80 -51.73 -68.56 0.16 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.961 -1.018 . . . . 0.0 111.376 177.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.801 HD12 ' HD1' ' A' ' 52' ' ' PHE . 9.8 mp -57.1 -36.22 70.35 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -175.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.45 -36.12 81.99 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.901 178.246 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -77.26 -23.66 51.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.872 0.368 . . . . 0.0 111.302 176.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.671 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 19.8 mmmt -77.28 -14.5 59.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.522 -178.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 116.0 22.81 4.46 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.58 -0.819 . . . . 0.0 113.179 176.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.504 ' HG ' HD13 ' A' ' 28' ' ' LEU . 5.7 mp -108.13 140.77 40.83 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.933 0.367 . . . . 0.0 110.739 177.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.8 p -84.43 174.02 10.41 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.834 172.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.578 ' HA ' HG22 ' A' ' 63' ' ' ILE . 0.4 OUTLIER -59.97 -40.89 90.61 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 -178.726 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -59.91 -40.34 88.52 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.289 0.566 . . . . 0.0 110.551 177.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -79.37 -28.04 41.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.146 -174.776 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.698 HG13 HD22 ' A' ' 53' ' ' LEU . 9.9 tt -69.53 -40.01 79.14 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.778 -178.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.624 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 0.4 OUTLIER -67.73 -40.52 84.19 Favored 'General case' 0 C--O 1.207 -1.149 0 C-N-CA 119.034 -1.066 . . . . 0.0 108.254 174.701 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.518 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 1.4 tpt -56.11 -42.77 77.36 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 120.958 0.409 . . . . 0.0 111.134 -177.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.44 -44.64 70.87 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.975 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.73 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.6 m-85 -69.43 -29.32 67.01 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.624 ' HG2' ' O ' ' A' ' 64' ' ' ASP . 69.6 mm-40 -62.88 -52.7 62.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.306 0.574 . . . . 0.0 109.757 178.14 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -67.92 -28.55 67.59 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.921 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.1 t -75.47 -10.01 59.07 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.203 0.525 . . . . 0.0 111.408 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 67.88 43.31 83.67 Favored Glycine 0 N--CA 1.451 -0.357 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.597 176.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.762 HG22 ' HG3' ' A' ' 42' ' ' ARG . 22.0 p . . . . . 0 C--N 1.323 -0.564 0 CA-C-O 120.535 0.207 . . . . 0.0 110.745 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 46.9 mtpt . . . . . 0 C--O 1.227 -0.103 0 N-CA-C 111.536 0.199 . . . . 0.0 111.536 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 105' ' ' PHE . . . . . 0.573 ' HZ ' ' HB2' ' A' ' 39' ' ' SER . 39.0 t80 -68.21 -27.47 66.41 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.801 0.334 . . . . 0.0 110.237 -178.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 106' ' ' PHE . . . . . 0.453 ' CD2' ' HZ ' ' A' ' 35' ' ' PHE . 60.6 m-85 -87.61 -23.73 24.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.162 0.506 . . . . 0.0 110.812 176.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -93.46 -64.78 1.05 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.589 -174.021 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -64.64 -22.04 66.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.61 -170.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.508 HD13 ' HA ' ' B' ' 105' ' ' PHE . 10.6 mp -82.72 -10.74 58.77 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.896 -0.322 . . . . 0.0 111.523 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 110' ' ' PHE . . . . . 0.54 ' CE1' ' HB3' ' A' ' 56' ' ' LYS . 2.7 t80 -101.39 -11.88 19.04 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 119.497 -0.881 . . . . 0.0 110.841 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -71.85 -71.93 0.25 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 173.153 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 52.0 m . . . . . 0 C--O 1.247 0.951 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.651 172.86 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.542 ' HA ' ' OE2' ' A' ' 62' ' ' GLU . 14.4 Cg_exo . . . . . 0 C--O 1.236 0.38 0 CA-C-O 120.788 0.245 . . . . 0.0 112.209 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -143.12 123.86 14.17 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.468 -178.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.649 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 0.5 OUTLIER -67.01 -40.7 30.87 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.374 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.649 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 9.4 Cg_endo -53.22 -35.63 74.49 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 122.145 1.897 . . . . 0.0 112.414 175.721 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.478 HD22 ' HB2' ' A' ' 58' ' ' LEU . 4.3 tt -76.13 -28.87 57.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.896 0.379 . . . . 0.0 110.027 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.507 HG12 HD11 ' A' ' 58' ' ' LEU . 70.7 mt -60.03 -41.84 87.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 172.215 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.71 -40.06 95.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.548 176.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.1 m -58.97 -41.07 86.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.3 0.571 . . . . 0.0 110.199 175.269 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.588 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -67.4 -45.12 77.09 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.076 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 29' ' ' ILE . 73.8 t -62.12 -45.26 99.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -177.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.62 -29.06 69.0 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.108 0.48 . . . . 0.0 110.237 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.491 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 79.9 t80 -66.19 -57.94 6.51 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.414 -0.812 . . . . 0.0 108.995 173.464 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.588 HD13 ' O ' ' A' ' 32' ' ' ALA . 1.2 mp -50.49 -56.86 9.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.541 -1.209 . . . . 0.0 112.127 -178.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.539 ' HG2' ' HD3' ' A' ' 42' ' ' ARG . 49.4 mt-30 -83.8 34.38 0.49 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -173.495 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -93.0 25.68 3.12 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 166.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.1 t 73.32 -64.15 0.41 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-N 114.767 -1.106 . . . . 0.0 111.724 178.06 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -65.53 -23.03 66.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.009 -172.019 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.487 ' HB ' ' O ' ' A' ' 36' ' ' LEU . 51.8 t -80.57 -37.74 17.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.245 -179.297 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.539 ' HD3' ' HG2' ' A' ' 37' ' ' GLN . 25.8 mtm180 -66.23 -22.7 66.34 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.225 -0.59 . . . . 0.0 109.689 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -99.46 9.92 42.36 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.761 174.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 28.0 t -91.53 142.41 26.84 Favored Pre-proline 0 C--N 1.326 -0.441 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 176.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.417 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 9.6 Cg_endo -49.91 128.39 21.71 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 123.547 2.832 . . . . 0.0 112.695 -178.317 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.518 ' O ' ' HG3' ' A' ' 50' ' ' ARG . 7.5 mp -60.93 -30.13 70.03 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.753 -178.427 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -51.23 -46.53 62.3 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 123.638 0.586 . . . . 0.0 110.787 176.351 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.503 HG21 ' CZ ' ' B' ' 106' ' ' PHE . 98.4 m -70.51 -53.31 16.71 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.358 176.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.501 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 16.7 mtm180 -55.39 -44.89 76.54 Favored 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.646 0.591 . . . . 0.0 112.235 -171.378 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.579 ' O ' ' HD3' ' A' ' 54' ' ' LYS . 67.1 mtm180 -63.16 -54.86 31.09 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.85 -176.049 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.493 ' O ' ' HG2' ' A' ' 55' ' ' LYS . . . -60.48 -43.46 96.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.953 0.406 . . . . 0.0 110.357 178.319 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.669 ' HD1' HD12 ' A' ' 53' ' ' LEU . 72.2 t80 -49.6 -57.6 6.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.727 178.031 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.669 HD12 ' HD1' ' A' ' 52' ' ' PHE . 8.6 mp -57.67 -43.99 85.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.717 -0.22 . . . . 0.0 111.38 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.847 ' HE3' HD13 ' A' ' 63' ' ' ILE . 2.2 mptm? -61.64 -46.68 88.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.777 0.322 . . . . 0.0 110.983 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 51' ' ' ALA . 14.5 mmmm -72.23 -23.87 61.3 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.9 -173.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.768 ' HE2' ' HA ' ' A' ' 56' ' ' LYS . 10.3 mmpt? -74.59 -19.2 60.41 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.767 0.317 . . . . 0.0 110.413 177.181 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.25 51.68 0.35 Allowed Glycine 0 N--CA 1.444 -0.776 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.444 177.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.572 HD23 HG22 ' A' ' 63' ' ' ILE . 22.8 tp -142.19 141.32 32.57 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -179.222 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.549 ' O ' HG23 ' A' ' 63' ' ' ILE . 1.2 m -76.18 157.02 33.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.713 -178.216 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.764 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 23.0 p-10 -60.75 -45.87 92.65 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -178.148 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.66 ' HG3' ' HG3' ' A' ' 62' ' ' GLU . 7.3 pt-20 -52.61 -37.52 58.46 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.699 0.762 . . . . 0.0 111.104 177.255 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.66 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 47.5 mt-10 -78.91 -27.3 43.78 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.915 -174.227 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.847 HD13 ' HE3' ' A' ' 54' ' ' LYS . 3.7 pt -70.51 -34.6 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.177 177.734 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.524 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 0.6 OUTLIER -68.44 -31.79 71.36 Favored 'General case' 0 C--O 1.209 -1.066 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 176.304 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 37.9 tpp -66.97 -42.68 84.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.843 0.354 . . . . 0.0 110.324 177.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.91 -47.46 83.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.151 176.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.501 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 6.9 m-85 -66.49 -31.68 72.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.0 177.233 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.524 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 24.8 tm0? -65.06 -49.74 68.89 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.314 0.578 . . . . 0.0 109.601 -179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -67.22 -30.88 70.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.048 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 32.4 m -83.37 7.74 15.75 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.492 -178.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 61.38 36.89 93.19 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 116.12 -0.491 . . . . 0.0 112.357 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.9 p . . . . . 0 C--N 1.323 -0.583 0 CA-C-O 121.036 0.446 . . . . 0.0 111.341 -175.019 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 89.1 tttt . . . . . 0 C--O 1.224 -0.258 0 CA-C-O 120.489 0.185 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -75.85 -17.38 59.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.8 0.333 . . . . 0.0 110.216 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 106' ' ' PHE . . . . . 0.565 ' HB3' ' CE2' ' A' ' 52' ' ' PHE . 56.4 m-85 -95.22 -18.61 20.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.4 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -97.8 -62.86 1.19 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.144 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -57.24 -48.02 79.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.18 0.514 . . . . 0.0 110.691 -175.269 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.489 HD13 ' O ' ' B' ' 109' ' ' LEU . 0.5 OUTLIER -70.91 -22.67 62.22 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.65 -176.089 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 110' ' ' PHE . . . . . 0.44 ' HE2' ' HA ' ' A' ' 32' ' ' ALA . 51.1 t80 -93.08 -43.33 8.93 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.078 -178.001 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -57.24 -43.47 82.96 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.26 -176.14 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 C--O 1.245 0.837 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.143 176.011 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.708 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 52.4 Cg_exo . . . . . 0 C--O 1.234 0.31 0 CA-C-O 120.837 0.266 . . . . 0.0 112.599 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -128.42 95.95 4.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.632 -176.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.607 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 34.6 tt0 -56.32 -42.99 99.02 Favored Pre-proline 0 CA--C 1.541 0.616 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.607 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 9.0 Cg_endo -52.63 -30.08 44.02 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 122.033 1.822 . . . . 0.0 112.537 176.442 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.649 HD22 HD13 ' A' ' 58' ' ' LEU . 7.1 tt -71.17 -22.0 62.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.416 -178.328 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.673 HD11 ' HB3' ' A' ' 62' ' ' GLU . 47.4 mm -58.74 -46.53 90.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.723 0.297 . . . . 0.0 110.349 176.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.12 -44.59 95.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.103 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 34.7 m -57.44 -38.3 74.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.723 176.058 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.787 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -68.99 -48.81 62.19 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.389 -179.027 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 29' ' ' ILE . 89.1 t -59.47 -45.57 93.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 111.422 0.156 . . . . 0.0 111.422 -177.647 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.593 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 0.0 OUTLIER -69.27 -23.74 63.88 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.888 0.375 . . . . 0.0 110.584 179.404 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.525 ' HZ ' ' CD2' ' B' ' 106' ' ' PHE . 86.5 t80 -70.48 -54.66 11.38 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.389 -0.596 . . . . 0.0 109.389 174.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.787 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 33.3 mt -57.01 -55.52 33.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.427 -176.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -95.17 28.11 2.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.137 -175.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' A' ' 34' ' ' LYS . 15.5 t-20 -68.84 -50.6 48.6 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 173.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.4 p -173.49 -68.08 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.414 176.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 55.8 mtp180 -95.41 -20.22 19.27 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -169.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.525 HG23 ' HE2' ' B' ' 105' ' ' PHE . 48.9 t -63.86 -34.97 71.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 CA-C-N 118.022 0.374 . . . . 0.0 111.498 -174.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.413 ' HD2' HG21 ' A' ' 72' ' ' THR . 6.6 mmm180 -58.3 -29.85 66.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.882 0.373 . . . . 0.0 110.769 174.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -99.02 -5.19 30.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.521 -177.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 51.0 m -80.93 146.77 60.15 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.229 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.403 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 54.1 Cg_exo -52.19 134.24 49.82 Favored 'Trans proline' 0 C--O 1.239 0.528 0 C-N-CA 123.023 2.482 . . . . 0.0 112.794 -178.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.464 ' O ' ' HG3' ' A' ' 50' ' ' ARG . 7.8 mp -64.07 -28.02 69.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.35 -175.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.17 -50.87 71.49 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.366 0.416 . . . . 0.0 110.528 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 98.9 m -57.42 -56.12 25.9 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.809 174.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.64 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 30.7 mtm180 -56.13 -43.49 78.24 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -170.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 66.4 mtm180 -69.24 -48.48 61.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.591 0.234 . . . . 0.0 111.441 -174.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.452 ' O ' ' HG3' ' A' ' 55' ' ' LYS . . . -64.83 -38.29 90.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.258 0.551 . . . . 0.0 109.787 177.105 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.613 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 55.3 t80 -48.96 -67.56 0.26 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.735 -1.12 . . . . 0.0 112.393 179.519 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 49' ' ' ARG . 0.4 OUTLIER -68.11 -29.98 69.03 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -174.523 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.874 ' HE2' HD13 ' A' ' 63' ' ' ILE . 59.0 mttm -59.14 -42.12 89.92 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.112 0.482 . . . . 0.0 110.224 173.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 51' ' ' ALA . 28.8 mtpp -74.94 -30.64 61.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.395 -178.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.613 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 11.4 mmpt? -64.42 -27.13 68.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.356 0.598 . . . . 0.0 109.966 176.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 127.57 65.92 0.14 Allowed Glycine 0 N--CA 1.443 -0.881 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.182 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.715 ' HG ' ' HB2' ' A' ' 62' ' ' GLU . 11.8 tp -151.23 144.51 24.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.002 0.43 . . . . 0.0 110.511 -178.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.579 ' O ' HG23 ' A' ' 63' ' ' ILE . 2.7 m -87.94 166.51 14.46 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.97 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.58 ' O ' HG12 ' A' ' 63' ' ' ILE . 4.6 m-20 -50.77 -57.7 7.72 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 122.88 0.472 . . . . 0.0 111.779 178.595 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.442 ' HA ' ' OD2' ' A' ' 64' ' ' ASP . 7.7 pt-20 -58.52 -27.63 64.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.756 -177.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.715 ' HB2' ' HG ' ' A' ' 58' ' ' LEU . 51.8 mt-10 -79.9 -28.17 39.86 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.854 -178.599 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.874 HD13 ' HE2' ' A' ' 54' ' ' LYS . 3.2 pt -70.11 -34.15 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 C-N-CA 119.952 -0.699 . . . . 0.0 109.758 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.442 ' OD2' ' HA ' ' A' ' 61' ' ' GLU . 3.0 p30 -77.3 -26.02 51.88 Favored 'General case' 0 C--O 1.21 -0.996 0 C-N-CA 119.532 -0.867 . . . . 0.0 110.223 173.299 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.642 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 0.3 OUTLIER -56.69 -50.94 70.65 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 119.599 -0.84 . . . . 0.0 108.786 173.318 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.42 -57.68 6.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.456 178.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.64 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 3.6 m-85 -66.13 -38.49 88.28 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -173.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -65.68 -45.75 81.68 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -178.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -77.24 -21.26 54.02 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.258 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 32.5 t -79.6 -14.9 58.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.67 0.271 . . . . 0.0 110.37 176.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 80.37 28.37 48.61 Favored Glycine 0 C--N 1.333 0.368 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.78 176.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.619 HG23 ' HD1' ' A' ' 67' ' ' PHE . 10.2 t . . . . . 0 C--N 1.325 -0.487 0 CA-C-O 122.107 0.956 . . . . 0.0 110.467 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 59.8 tttp . . . . . 0 N--CA 1.462 0.13 0 CA-C-O 121.136 0.493 . . . . 0.0 110.155 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 105' ' ' PHE . . . . . 0.525 ' HE2' HG23 ' A' ' 41' ' ' VAL . 33.4 t80 -69.57 -42.3 74.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.66 -177.276 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 106' ' ' PHE . . . . . 0.525 ' CD2' ' HZ ' ' A' ' 35' ' ' PHE . 37.8 m-85 -75.92 -38.29 57.85 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -178.622 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.3 -60.16 2.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.238 -172.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -61.09 -49.97 75.17 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -171.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.593 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 72.6 mt -58.5 -33.96 70.4 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.735 0.302 . . . . 0.0 111.429 -176.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 110' ' ' PHE . . . . . 0.679 ' HE2' ' HA ' ' A' ' 32' ' ' ALA . 6.1 t80 -92.02 -5.95 52.01 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.212 -174.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -73.83 -23.68 59.68 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.816 -178.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.987 -0.53 . . . . 0.0 109.762 176.124 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.473 ' HA ' ' O ' ' A' ' 57' ' ' GLY . 21.5 Cg_exo . . . . . 0 N--CA 1.461 -0.413 0 CA-C-O 120.926 0.303 . . . . 0.0 111.878 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.424 ' HB2' ' HB2' ' A' ' 28' ' ' LEU . 74.4 mtt180 -119.71 160.79 21.87 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.685 179.046 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.612 ' HB2' ' HD3' ' A' ' 27' ' ' PRO . 39.4 mt-10 -66.18 -55.05 22.41 Favored Pre-proline 0 CA--C 1.539 0.527 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -174.326 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.612 ' HD3' ' HB2' ' A' ' 26' ' ' GLU . 86.1 Cg_endo -78.85 -16.87 12.57 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 122.083 1.855 . . . . 0.0 112.72 -175.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.424 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 3.4 tt -65.72 -30.52 71.2 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.239 -175.67 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.7 mt -64.68 -37.76 80.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.125 0.488 . . . . 0.0 110.082 175.124 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.477 ' HA ' HG12 ' A' ' 33' ' ' VAL . . . -70.81 -39.15 73.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.519 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.6 m -61.13 -39.48 90.2 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 121.024 0.44 . . . . 0.0 110.041 174.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.733 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -66.93 -49.13 66.47 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.436 179.454 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.477 HG12 ' HA ' ' A' ' 30' ' ' ALA . 9.8 p -64.34 -35.22 73.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.615 -178.418 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.535 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.6 tmmm? -59.09 -52.26 66.52 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 172.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.505 ' HZ ' ' CD2' ' B' ' 106' ' ' PHE . 85.9 t80 -50.95 -52.8 38.76 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.571 179.178 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.733 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 39.3 mt -59.63 -40.38 87.44 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.764 -176.106 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.407 HE21 ' HA ' ' A' ' 70' ' ' SER . 95.8 mt-30 -85.95 32.01 0.61 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -172.06 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -101.71 28.99 5.18 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.239 0.542 . . . . 0.0 109.683 170.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.3 m 70.56 -66.95 0.26 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 114.711 -1.132 . . . . 0.0 112.339 175.675 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -57.54 -36.12 71.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.635 -173.477 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.678 HG12 ' HD3' ' A' ' 49' ' ' ARG . 51.5 t -63.03 -44.62 99.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.406 -176.855 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.514 ' HD2' ' CG2' ' A' ' 72' ' ' THR . 32.9 mtm180 -67.35 -18.76 65.28 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.007 0.432 . . . . 0.0 110.337 -177.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -96.73 -0.87 47.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.682 178.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.6 m -88.22 153.18 51.17 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.289 175.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -60.97 142.37 97.32 Favored 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 122.547 2.165 . . . . 0.0 112.579 -177.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.4 mt -63.11 -23.58 67.51 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.701 177.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.6 -47.59 73.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.355 174.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 73.7 m -70.49 -59.57 2.77 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.324 174.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.897 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 41.0 mtm180 -52.94 -47.41 68.07 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -171.31 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.433 ' HG2' ' HE2' ' A' ' 67' ' ' PHE . 80.5 mtm180 -67.38 -52.74 36.39 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 121.156 -0.218 . . . . 0.0 111.46 -174.274 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.44 -34.68 78.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.148 0.499 . . . . 0.0 110.389 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.624 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 49.8 t80 -54.88 -66.41 0.41 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.143 -0.935 . . . . 0.0 112.339 179.725 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 49' ' ' ARG . 0.5 OUTLIER -68.07 -23.73 64.98 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.713 -173.809 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.584 ' HA ' ' O ' ' A' ' 58' ' ' LEU . 97.4 mttt -63.15 -48.62 77.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.985 0.421 . . . . 0.0 110.683 173.788 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -67.85 -22.39 65.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.698 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.624 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 11.4 mmpt? -69.78 -45.38 68.13 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.99 176.035 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.473 ' O ' ' HA ' ' A' ' 24' ' ' PRO . . . 150.79 62.73 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.206 -0.997 . . . . 0.0 113.724 176.542 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.59 HD11 HD13 ' A' ' 53' ' ' LEU . 3.0 pp -171.89 148.36 2.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.938 0.399 . . . . 0.0 110.75 173.221 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.625 HG22 ' H ' ' A' ' 60' ' ' ASP . 1.5 m -93.75 177.05 6.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.02 -177.836 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.681 ' O ' HG12 ' A' ' 63' ' ' ILE . 2.7 m-20 -49.81 -46.03 50.58 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -174.365 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 65' ' ' MET . 8.6 pt-20 -52.15 -40.29 61.2 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.163 0.506 . . . . 0.0 111.356 178.503 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.572 ' CB ' ' HB2' ' A' ' 58' ' ' LEU . 1.5 mp0 -77.45 -27.03 52.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.354 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.681 HG12 ' O ' ' A' ' 60' ' ' ASP . 2.4 pt -69.53 -39.62 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 120.269 -0.573 . . . . 0.0 110.158 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.54 -26.8 63.73 Favored 'General case' 0 C--O 1.211 -0.956 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 176.261 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.559 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 19.0 mmt -64.84 -49.9 68.76 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.227 175.272 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.72 -40.86 84.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.169 0.509 . . . . 0.0 110.365 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.897 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.8 m-85 -69.82 -28.56 65.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.194 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.3 tp60 -65.87 -50.06 65.9 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.037 0.446 . . . . 0.0 110.058 176.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -62.62 -36.94 84.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.888 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.407 ' HA ' HE21 ' A' ' 37' ' ' GLN . 32.4 p -83.86 0.23 48.48 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.572 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.91 37.19 94.28 Favored Glycine 0 C--N 1.334 0.433 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.738 177.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.514 ' CG2' ' HD2' ' A' ' 42' ' ' ARG . 35.9 p . . . . . 0 C--N 1.324 -0.523 0 CA-C-O 121.074 0.464 . . . . 0.0 111.837 -176.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 104' ' ' LYS . . . . . 0.59 ' HA ' ' HG2' ' B' ' 107' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.226 -0.145 0 CA-C-O 120.599 0.237 . . . . 0.0 110.894 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -70.78 -35.11 72.42 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.787 0.327 . . . . 0.0 110.228 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 106' ' ' PHE . . . . . 0.505 ' CD2' ' HZ ' ' A' ' 35' ' ' PHE . 12.3 m-85 -79.02 -33.48 44.8 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.526 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 107' ' ' GLN . . . . . 0.59 ' HG2' ' HA ' ' B' ' 104' ' ' LYS . 11.4 pt20 -91.65 -50.15 5.91 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -175.495 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 108' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' B' ' 107' ' ' GLN . 20.5 tt0 -78.58 -28.69 45.91 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 111.628 0.233 . . . . 0.0 111.628 -169.451 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.535 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 42.2 tp -69.66 -19.3 63.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.08 0.467 . . . . 0.0 110.161 178.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 110' ' ' PHE . . . . . 0.503 ' CE2' ' HA ' ' A' ' 32' ' ' ALA . 2.3 t80 -97.16 -5.2 37.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.855 -179.307 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -63.33 -52.48 61.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.385 0.612 . . . . 0.0 109.926 177.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 C--O 1.248 0.981 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.606 179.226 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.544 ' HB3' ' HG2' ' A' ' 62' ' ' GLU . 28.7 Cg_endo . . . . . 0 CA--C 1.527 0.17 0 CA-C-O 121.399 0.499 . . . . 0.0 111.988 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.569 ' HB2' ' HB2' ' A' ' 28' ' ' LEU . 74.6 mtt180 -90.2 147.52 23.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.927 -177.293 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.469 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 13.2 tp10 -61.97 -53.09 62.99 Favored Pre-proline 0 CA--C 1.539 0.533 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.131 -179.305 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 26.8 Cg_endo -64.2 -20.14 66.71 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 121.993 1.796 . . . . 0.0 112.178 178.313 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.569 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 46.7 tp -67.78 -46.26 72.51 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.838 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 50.7 mm -64.12 -42.05 94.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.168 177.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.42 -43.19 93.1 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.181 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 31.7 m -67.91 -36.56 80.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.617 178.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.508 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -61.7 -40.62 95.65 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.749 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 80.3 t -64.89 -43.21 96.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.807 0.337 . . . . 0.0 110.334 177.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.453 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 5.4 tmtm? -55.87 -45.46 78.51 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.166 174.757 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.556 ' O ' HG21 ' A' ' 41' ' ' VAL . 78.5 t80 -60.96 -56.92 15.42 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.342 178.385 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.508 HD13 ' O ' ' A' ' 32' ' ' ALA . 0.6 OUTLIER -51.59 -42.02 61.62 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.342 -176.207 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -92.06 39.62 1.02 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.328 0.585 . . . . 0.0 111.926 -174.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.679 ' HB3' HG23 ' A' ' 41' ' ' VAL . 27.8 t-20 -88.21 6.45 36.67 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 167.165 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.442 ' HB3' ' O ' ' A' ' 38' ' ' ASN . 46.8 t 76.44 -60.74 0.47 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.792 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 77.6 mtt180 -69.15 -16.34 63.62 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -177.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.679 HG23 ' HB3' ' A' ' 38' ' ' ASN . 97.4 t -69.56 -32.41 52.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.854 0.359 . . . . 0.0 111.138 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 66.1 mtp180 -74.57 -33.19 62.63 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.126 177.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -76.75 -32.45 57.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.993 177.15 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -58.91 132.67 86.86 Favored Pre-proline 0 N--CA 1.45 -0.435 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.454 173.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -43.89 124.69 4.78 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.542 2.828 . . . . 0.0 113.04 -174.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.708 ' HA ' ' CG ' ' A' ' 49' ' ' ARG . 5.9 mp -69.54 -18.85 63.7 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.298 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -52.06 -42.71 63.36 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 168.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.491 HG21 ' CE2' ' B' ' 106' ' ' PHE . 68.5 m -67.91 -41.26 82.94 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.263 173.078 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.708 ' CG ' ' HA ' ' A' ' 46' ' ' LEU . 13.4 mmp_? -53.07 -45.83 68.32 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.49 -176.758 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.579 ' O ' ' HE3' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -62.3 -57.62 10.69 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.834 -0.346 . . . . 0.0 111.644 -179.153 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.37 -42.63 96.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.125 0.488 . . . . 0.0 110.888 -178.125 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -59.48 -50.5 73.68 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.267 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.521 HD23 ' O ' ' A' ' 49' ' ' ARG . 1.8 mm? -60.29 -47.15 87.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.96 0.41 . . . . 0.0 110.622 179.232 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.811 ' HE2' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -64.87 -35.29 80.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.509 -178.434 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.404 ' HD3' ' HA ' ' A' ' 55' ' ' LYS . 31.8 mmtm -78.3 -23.28 47.21 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.879 ' HE2' ' HA ' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -75.74 -11.07 59.92 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.605 0.241 . . . . 0.0 111.039 -177.843 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 114.06 25.92 3.99 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.123 -1.036 . . . . 0.0 114.108 170.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.601 ' CD1' HG22 ' A' ' 63' ' ' ILE . 2.3 pp -135.87 139.39 43.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 117.396 0.598 . . . . 0.0 110.459 177.524 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.38 173.04 11.45 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.775 -176.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.679 ' O ' HG12 ' A' ' 63' ' ' ILE . 14.0 m-20 -52.06 -47.49 65.1 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -173.106 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -61.65 -28.5 69.43 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.369 -178.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.544 ' HG2' ' HB3' ' A' ' 24' ' ' PRO . 4.9 mp0 -74.98 -29.66 60.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.743 -0.208 . . . . 0.0 110.762 176.841 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.811 HD13 ' HE2' ' A' ' 54' ' ' LYS . 1.7 pt -69.96 -42.48 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 120.246 -0.582 . . . . 0.0 109.47 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.539 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 9.8 m-20 -73.56 -16.13 61.27 Favored 'General case' 0 C--O 1.211 -0.963 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 177.43 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.414 ' O ' ' HB3' ' A' ' 68' ' ' GLN . 32.4 tpp -73.04 -50.29 23.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.888 0.375 . . . . 0.0 110.441 173.648 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.06 -39.47 90.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.308 0.575 . . . . 0.0 109.937 178.265 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.507 ' HE1' ' HG ' ' A' ' 36' ' ' LEU . 10.3 m-85 -72.91 -27.76 62.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.925 176.363 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.539 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 22.3 tt0 -60.2 -54.65 43.29 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.488 0.661 . . . . 0.0 109.788 174.088 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -65.93 -27.12 67.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.983 -176.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.3 m -84.08 -9.7 58.4 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.017 177.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 68.75 36.85 83.41 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.367 178.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 41.0 p . . . . . 0 C--N 1.321 -0.634 0 CA-C-O 120.947 0.403 . . . . 0.0 111.337 -176.402 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 81.5 mttt . . . . . 0 C--O 1.222 -0.343 0 CA-C-O 120.967 0.413 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -62.59 -23.2 66.91 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.395 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 106' ' ' PHE . . . . . 0.491 ' CE2' HG21 ' A' ' 48' ' ' THR . 55.6 m-85 -96.22 -51.49 4.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.544 177.631 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -80.78 -46.71 14.97 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -173.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.77 -49.0 74.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.491 -173.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 109' ' ' LEU . . . . . 0.453 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 89.4 mt -68.99 -9.81 54.25 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -175.089 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 110' ' ' PHE . . . . . 0.441 ' CE2' ' HA ' ' A' ' 32' ' ' ALA . 5.5 t80 -104.18 -5.9 21.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.109 0.481 . . . . 0.0 110.548 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -76.63 -26.15 54.61 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.966 0.412 . . . . 0.0 110.587 -175.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 64.9 m . . . . . 0 C--O 1.247 0.968 0 CA-C-O 118.603 -0.713 . . . . 0.0 110.131 176.095 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 21' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.46 0 N-CA-C 110.364 -0.235 . . . . 0.0 110.364 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.445 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 8.3 t30 73.88 -28.79 0.19 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.287 0.635 . . . . 0.0 111.456 178.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.637 ' HA ' ' HA2' ' A' ' 57' ' ' GLY . 15.9 t -78.9 66.28 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.529 0.681 . . . . 0.0 110.657 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 24' ' ' PRO . 4.3 tt -98.5 114.18 65.02 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 174.191 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 23' ' ' LEU . 18.2 Cg_endo -58.05 109.14 0.45 Allowed 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.996 2.464 . . . . 0.0 112.269 -177.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.467 ' HB3' ' HG2' ' A' ' 27' ' ' PRO . 92.5 mtt180 -135.88 139.09 43.1 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.778 -175.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.603 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 36.3 tt0 -61.36 -41.2 78.33 Favored Pre-proline 0 CA--C 1.54 0.57 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.275 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.603 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 5.0 Cg_endo -50.88 -30.74 31.21 Favored 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 122.061 1.84 . . . . 0.0 112.412 173.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 99.7 mt -68.5 -44.52 74.52 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 43.7 mm -58.62 -49.1 83.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.2 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.92 -47.37 83.03 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.14 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 32.1 m -64.34 -36.01 82.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.886 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.78 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -69.11 -49.51 56.48 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.401 -178.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 90.9 t -57.44 -42.24 80.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-O 120.751 0.31 . . . . 0.0 110.458 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.549 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.7 tmmm? -58.42 -48.11 81.76 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.995 174.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.629 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 80.1 t80 -56.7 -54.86 41.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.7 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.78 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 32.9 mt -58.05 -54.51 46.17 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.533 -174.664 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -93.59 20.31 7.53 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.656 -173.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -66.87 -53.9 27.69 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 174.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.2 p -172.48 -69.32 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.174 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -91.07 -21.54 21.18 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -167.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.506 ' HB ' ' HA ' ' A' ' 36' ' ' LEU . 40.1 t -67.29 -33.27 61.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.728 -173.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.546 ' HG2' ' O ' ' A' ' 36' ' ' LEU . 13.1 mmm180 -62.99 -28.49 70.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.019 0.437 . . . . 0.0 110.357 175.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -95.57 -6.32 40.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.976 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.2 t -80.11 136.78 53.48 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.012 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_exo -57.92 143.3 96.21 Favored 'Trans proline' 0 C--O 1.237 0.428 0 C-N-CA 122.963 2.442 . . . . 0.0 111.96 178.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.767 HD13 ' HB3' ' A' ' 75' ' ' ASP . 0.9 OUTLIER -68.72 -19.51 64.36 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.206 -176.953 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -53.29 -42.29 66.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.743 0.306 . . . . 0.0 110.337 172.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 84.7 m -71.22 -53.04 15.76 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.48 172.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.551 HH21 HD21 ' A' ' 46' ' ' LEU . 15.6 mtm180 -60.18 -34.2 73.27 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -169.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.469 ' HA ' HD11 ' A' ' 63' ' ' ILE . 6.1 mpp_? -67.67 -56.77 8.06 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 121.263 -0.175 . . . . 0.0 111.332 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.449 ' O ' ' HG3' ' A' ' 55' ' ' LYS . . . -59.7 -43.29 94.15 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 177.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.811 ' HD1' HD12 ' A' ' 53' ' ' LEU . 79.6 t80 -50.66 -66.92 0.3 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.414 -178.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.811 HD12 ' HD1' ' A' ' 52' ' ' PHE . 8.2 mp -60.32 -40.03 89.16 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.729 0.299 . . . . 0.0 111.292 -175.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 58' ' ' LEU . 60.1 mttm -63.24 -37.76 88.49 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.225 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 51' ' ' ALA . 29.6 mtpp -78.64 -27.62 45.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.47 179.127 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.948 ' HE2' ' HA ' ' A' ' 56' ' ' LYS . 9.3 mmpt? -69.75 -25.29 63.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.205 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.637 ' HA2' ' HA ' ' A' ' 22' ' ' VAL . . . 135.65 2.54 2.84 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.157 -1.02 . . . . 0.0 113.02 177.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.541 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 5.8 mp -92.45 126.69 37.64 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.865 0.364 . . . . 0.0 110.459 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.584 HG23 HG12 ' A' ' 22' ' ' VAL . 2.2 p -70.4 173.63 6.66 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 116.244 -0.435 . . . . 0.0 109.952 174.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.613 ' O ' HG22 ' A' ' 63' ' ' ILE . 3.3 m-20 -56.25 -45.07 80.2 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.263 0.554 . . . . 0.0 110.392 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.455 ' O ' ' HG2' ' A' ' 65' ' ' MET . 10.3 pt-20 -56.3 -42.43 77.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.065 177.069 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -72.29 -33.59 67.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.424 -174.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.728 HG13 HD22 ' A' ' 53' ' ' LEU . 17.4 tt -69.71 -36.27 69.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 120.001 -0.679 . . . . 0.0 110.816 -177.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.66 -28.13 58.62 Favored 'General case' 0 C--O 1.211 -0.969 0 C-N-CA 119.072 -1.051 . . . . 0.0 109.316 173.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.476 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 21.9 mmt -59.45 -51.88 68.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.806 0.336 . . . . 0.0 110.246 175.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.94 -42.29 99.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.074 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.529 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 6.8 m-85 -73.13 -29.05 62.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.941 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -71.48 -40.45 70.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.217 0.532 . . . . 0.0 109.8 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.454 ' HG2' ' O ' ' A' ' 65' ' ' MET . 14.5 mm100 -69.95 -39.99 75.72 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.113 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 27.1 p -78.11 -24.28 47.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.022 0.439 . . . . 0.0 110.857 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 73.43 70.36 1.25 Allowed Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 121.091 -0.576 . . . . 0.0 113.151 174.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.0 p -88.11 -55.68 3.65 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.218 -0.289 . . . . 0.0 110.218 174.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 50.96 69.04 0.69 Allowed 'General case' 0 C--O 1.234 0.254 0 O-C-N 123.867 0.729 . . . . 0.0 112.088 175.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -144.72 -86.57 0.12 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.305 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.767 ' HB3' HD13 ' A' ' 46' ' ' LEU . 11.3 t70 -118.4 87.2 2.68 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 174.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.68 -166.182 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 6.1 p . . . . . 0 N--CA 1.473 0.724 0 CA-C-O 121.166 0.508 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 -72.86 -31.68 64.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.523 -178.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -60.06 -46.1 90.68 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.423 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -67.62 -27.33 66.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.407 178.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -62.52 -32.52 73.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.523 178.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 106' ' ' PHE . . . . . 0.629 ' HD2' ' HZ ' ' A' ' 35' ' ' PHE . 62.1 m-85 -76.99 -26.67 54.15 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.435 0.636 . . . . 0.0 110.141 178.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -91.55 -61.44 1.64 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.841 -172.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -60.25 -45.83 91.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.614 -175.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.549 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 34.6 tp -68.22 -30.92 70.09 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.532 -174.123 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 110' ' ' PHE . . . . . 0.612 ' HE2' ' HA ' ' A' ' 32' ' ' ALA . 8.5 t80 -92.45 -16.57 25.69 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.803 -177.406 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -59.37 -43.92 92.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.228 0.537 . . . . 0.0 110.051 176.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 37.6 m . . . . . 0 C--O 1.251 1.159 0 CA-C-N 115.219 -0.901 . . . . 0.0 109.538 177.698 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 . . . . . 0 N--CA 1.461 0.089 0 CA-C-O 120.749 0.309 . . . . 0.0 111.491 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -92.17 26.8 2.39 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.19 0.519 . . . . 0.0 110.572 -176.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.8 p -104.57 13.93 7.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.95 -179.126 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 66.1 tp -56.2 105.4 0.52 Allowed Pre-proline 0 N--CA 1.463 0.206 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.417 -176.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.802 ' HB2' ' HG3' ' A' ' 62' ' ' GLU . 96.5 Cg_endo -92.09 112.95 0.31 Allowed 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 123.178 2.585 . . . . 0.0 112.411 -176.275 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 66.8 mtm180 -134.01 169.8 16.58 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.979 179.558 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.551 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 8.8 tp10 -53.87 -50.9 81.3 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -176.252 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.551 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 10.2 Cg_endo -52.48 -28.26 35.25 Favored 'Trans proline' 0 C--N 1.36 1.154 0 C-N-CA 122.745 2.297 . . . . 0.0 113.359 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 57' ' ' GLY . 4.4 mm? -68.59 -44.78 73.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.781 0.324 . . . . 0.0 110.519 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.442 ' O ' HG23 ' A' ' 33' ' ' VAL . 46.2 mm -60.89 -49.89 82.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.479 -179.566 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.13 -47.69 80.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.502 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 28.1 m -65.99 -37.61 86.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.742 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.8 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -67.24 -48.51 67.58 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.042 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.452 HG13 ' HB3' ' A' ' 70' ' ' SER . 84.3 t -58.76 -42.58 85.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-O 120.552 0.215 . . . . 0.0 110.826 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.504 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.6 tmmm? -55.75 -46.01 77.94 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.274 0.559 . . . . 0.0 109.918 174.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.506 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 73.9 t80 -61.53 -52.61 63.75 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.718 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.954 ' HA ' HG11 ' A' ' 41' ' ' VAL . 54.5 mt -57.92 -37.57 74.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.042 -173.245 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -96.96 34.5 1.71 Allowed 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 120.836 0.351 . . . . 0.0 111.576 -177.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -94.06 28.69 2.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.157 0.503 . . . . 0.0 110.15 175.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.2 t 69.04 -67.47 0.21 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.704 176.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -64.92 -22.86 67.07 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.28 -175.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.954 HG11 ' HA ' ' A' ' 36' ' ' LEU . 40.9 t -68.73 -33.1 57.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -178.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -80.7 -18.26 48.46 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.044 0.449 . . . . 0.0 110.628 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -86.82 -35.34 19.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.323 0.582 . . . . 0.0 109.459 173.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.492 ' CB ' HH12 ' A' ' 49' ' ' ARG . 43.2 t -65.26 133.45 95.52 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.224 176.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -42.91 128.37 5.19 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 124.206 3.271 . . . . 0.0 114.272 -174.184 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.533 ' H ' HD12 ' A' ' 46' ' ' LEU . 4.6 mp -64.57 -20.24 66.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.948 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -55.39 -44.17 75.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.435 173.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.1 m -67.14 -40.92 86.8 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.822 174.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.538 ' HB3' ' CZ ' ' A' ' 67' ' ' PHE . 16.9 mmp_? -52.59 -48.84 66.01 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.525 -174.408 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -58.68 -61.41 2.63 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.642 0.258 . . . . 0.0 111.633 -176.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.08 -42.12 97.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.782 -178.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.707 ' HD1' HD12 ' A' ' 53' ' ' LEU . 58.4 t80 -51.78 -58.22 7.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.258 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.822 HD22 HG13 ' A' ' 63' ' ' ILE . 8.0 mp -60.58 -44.89 95.69 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 121.049 -0.26 . . . . 0.0 111.221 -177.372 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -67.46 -30.9 70.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.044 0.45 . . . . 0.0 111.544 -175.072 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.8 mmtm -78.54 -22.92 46.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.537 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.437 ' HD2' ' O ' ' A' ' 52' ' ' PHE . 1.0 OUTLIER -74.46 -41.31 61.0 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.587 175.733 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.525 ' O ' ' HG ' ' A' ' 28' ' ' LEU . . . 148.2 69.66 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.178 -1.011 . . . . 0.0 113.532 175.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.676 HD11 ' HB3' ' A' ' 53' ' ' LEU . 3.5 pp -166.1 150.82 8.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.854 0.359 . . . . 0.0 110.452 174.508 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.4 p -90.35 178.17 6.2 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.775 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.466 ' HA ' HG22 ' A' ' 63' ' ' ILE . 1.0 OUTLIER -55.23 -40.09 70.46 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -178.567 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -64.48 -35.64 81.59 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.001 0.429 . . . . 0.0 110.867 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.802 ' HG3' ' HB2' ' A' ' 24' ' ' PRO . 15.0 mm-40 -79.72 -29.1 40.56 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -177.096 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.822 HG13 HD22 ' A' ' 53' ' ' LEU . 11.6 tt -70.26 -37.06 70.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.043 -0.663 . . . . 0.0 111.083 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -77.47 -19.12 56.43 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 119.088 -1.045 . . . . 0.0 110.16 171.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.655 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 0.7 OUTLIER -61.82 -46.15 90.73 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 171.874 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.83 -46.37 45.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.536 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.582 ' CD1' HD13 ' A' ' 36' ' ' LEU . 0.9 OUTLIER -71.06 -41.64 70.47 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -176.814 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -67.73 -42.57 81.66 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.966 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -61.22 -39.73 91.37 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.901 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.452 ' HB3' HG13 ' A' ' 33' ' ' VAL . 25.0 p -74.7 -6.93 51.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.869 0.366 . . . . 0.0 111.225 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 84.44 8.34 83.42 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 121.01 -0.614 . . . . 0.0 111.899 178.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.2 m -85.64 96.34 9.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.889 0.376 . . . . 0.0 110.731 -177.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.99 81.62 2.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.204 0.526 . . . . 0.0 110.035 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.468 ' HB1' HD23 ' A' ' 46' ' ' LEU . . . -93.63 44.44 1.13 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.227 -177.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.9 t70 57.97 -141.07 0.75 Allowed 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 -174.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 . . . . . 0 C--N 1.323 -0.563 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 168.601 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 19.1 p . . . . . 0 N--CA 1.475 0.809 0 CA-C-O 120.561 0.219 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -75.44 -25.85 57.81 Favored 'General case' 0 C--N 1.334 -0.084 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -175.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.29 -35.36 79.31 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.115 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -71.9 -35.11 69.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.16 0.505 . . . . 0.0 110.134 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -59.85 -35.55 75.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.348 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 106' ' ' PHE . . . . . 0.534 ' HB3' ' CE2' ' A' ' 52' ' ' PHE . 20.1 m-85 -77.13 -24.77 51.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.227 179.294 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -93.94 -59.12 2.05 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.784 -174.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.3 -30.73 71.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.816 -171.058 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.504 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 87.6 mt -77.17 -29.54 54.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.705 0.288 . . . . 0.0 111.063 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 110' ' ' PHE . . . . . 0.424 ' CD1' ' HG2' ' A' ' 56' ' ' LYS . 1.1 t80 -90.19 -6.31 55.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.226 0.536 . . . . 0.0 110.19 -178.663 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -62.26 -52.5 63.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.409 177.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.249 1.051 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.502 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.676 ' HB2' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.43 0 CA-C-O 121.21 0.529 . . . . 0.0 111.009 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.475 ' O ' ' HA2' ' A' ' 57' ' ' GLY . 95.4 m-20 67.96 29.42 6.5 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.281 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.922 HG12 HG22 ' A' ' 59' ' ' THR . 16.5 t -92.8 66.66 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.528 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.554 ' O ' ' HA ' ' A' ' 58' ' ' LEU . 54.4 tp -98.63 108.03 46.02 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.033 -0.985 . . . . 0.0 112.004 -171.302 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -86.79 94.38 0.51 Allowed 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.535 2.157 . . . . 0.0 112.258 176.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.44 ' HD3' HD21 ' A' ' 23' ' ' LEU . 79.4 mtp180 -134.03 142.61 47.67 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.231 0.538 . . . . 0.0 112.134 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.511 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 15.4 tp10 -55.16 -52.36 71.9 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 114.765 -1.107 . . . . 0.0 112.556 177.441 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 10.6 Cg_endo -55.43 -35.17 91.47 Favored 'Trans proline' 0 C--N 1.358 1.071 0 C-N-CA 122.371 2.047 . . . . 0.0 112.768 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 57' ' ' GLY . 0.6 OUTLIER -64.67 -44.18 91.2 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -178.538 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.1 mt -58.62 -42.97 86.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.484 178.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.04 -44.58 97.19 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.308 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.3 m -69.02 -35.24 76.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.859 178.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.565 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -62.35 -45.12 94.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.195 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.7 t -67.5 -36.66 77.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.708 0.29 . . . . 0.0 110.38 178.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.58 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.5 tmtm? -56.8 -52.38 65.29 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.209 0.528 . . . . 0.0 109.594 173.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.524 ' O ' HG21 ' A' ' 41' ' ' VAL . 85.6 t80 -56.11 -51.96 66.02 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.043 177.28 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.565 HD13 ' O ' ' A' ' 32' ' ' ALA . 2.8 mp -52.08 -58.25 7.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.4 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -92.58 43.21 1.12 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.294 0.569 . . . . 0.0 111.828 -173.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -75.83 -56.62 4.5 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 167.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.8 p 173.16 -64.75 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.402 176.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.425 ' HE ' ' HB2' ' A' ' 40' ' ' ARG . 15.3 ttm180 -80.22 -25.73 39.48 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.728 -170.072 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.524 HG21 ' O ' ' A' ' 35' ' ' PHE . 74.0 t -58.13 -38.57 68.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -171.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.7 mtm180 -74.88 -11.83 60.22 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.921 0.391 . . . . 0.0 110.851 -177.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -106.69 2.16 25.6 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.111 0.482 . . . . 0.0 110.198 177.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 41.5 m -85.07 144.02 40.69 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.722 177.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -49.94 122.13 8.59 Favored 'Trans proline' 0 C--O 1.237 0.472 0 C-N-CA 122.964 2.443 . . . . 0.0 112.555 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.685 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 37.0 mt -62.55 -20.09 64.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.312 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -49.58 -49.09 47.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.835 0.35 . . . . 0.0 110.674 172.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.502 HG21 ' CZ ' ' B' ' 106' ' ' PHE . 63.6 m -70.42 -42.91 70.97 Favored 'General case' 0 C--O 1.22 -0.485 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 173.138 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.671 ' HB2' ' HA ' ' A' ' 46' ' ' LEU . 0.8 OUTLIER -53.34 -44.98 68.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.389 -174.212 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.685 ' HG2' ' O ' ' A' ' 46' ' ' LEU . 30.3 mmt180 -64.23 -61.69 2.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.827 0.346 . . . . 0.0 110.313 -177.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.98 -33.37 71.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.808 -177.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.68 ' HD1' HD12 ' A' ' 53' ' ' LEU . 72.4 t80 -54.69 -56.19 21.77 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.707 -0.678 . . . . 0.0 111.605 179.308 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.68 HD12 ' HD1' ' A' ' 52' ' ' PHE . 9.7 mp -63.66 -39.11 93.51 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.83 -0.348 . . . . 0.0 111.056 -178.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.717 ' HE2' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -66.77 -38.24 86.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.885 0.374 . . . . 0.0 111.646 -179.572 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.568 ' NZ ' ' HA ' ' A' ' 55' ' ' LYS . 0.8 OUTLIER -79.87 -30.02 40.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 179.606 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.66 ' HE2' ' HA ' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -70.75 -28.67 64.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.03 0.443 . . . . 0.0 110.599 -176.416 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.585 ' O ' ' HG ' ' A' ' 28' ' ' LEU . . . 128.86 64.78 0.11 Allowed Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.213 177.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.561 HD13 HD12 ' A' ' 28' ' ' LEU . 15.2 tp -160.6 155.65 24.44 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 -178.28 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.922 HG22 HG12 ' A' ' 22' ' ' VAL . 4.5 p -95.4 163.34 13.28 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.014 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.787 ' O ' HG12 ' A' ' 63' ' ' ILE . 4.9 m-20 -55.66 -37.99 68.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.679 0.276 . . . . 0.0 111.33 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -52.52 -52.13 56.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.95 0.405 . . . . 0.0 111.514 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.436 ' HB2' ' HG ' ' A' ' 58' ' ' LEU . 8.8 mp0 -72.49 -25.34 61.38 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.423 -176.086 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.787 HG12 ' O ' ' A' ' 60' ' ' ASP . 8.1 pt -64.12 -38.85 83.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 C-N-CA 119.695 -0.802 . . . . 0.0 110.718 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.11 -30.84 63.93 Favored 'General case' 0 C--O 1.206 -1.204 0 C-N-CA 119.361 -0.936 . . . . 0.0 109.001 173.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.424 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 2.4 tpt -59.01 -45.17 91.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.088 0.471 . . . . 0.0 109.967 177.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.31 -48.96 54.26 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.147 177.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.468 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.3 m-85 -65.73 -32.35 73.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.841 -178.075 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -67.93 -44.53 76.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.441 0.639 . . . . 0.0 109.548 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -70.95 -28.83 64.77 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.668 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.9 t -73.15 -15.23 61.47 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.571 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.96 -4.65 75.24 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.09 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 18.4 p -79.97 68.49 6.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.364 0.602 . . . . 0.0 111.197 -177.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.36 52.17 2.43 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.492 179.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -132.51 125.69 31.18 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.07 -178.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.9 t70 71.72 133.16 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 O-C-N 124.098 0.874 . . . . 0.0 110.345 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.877 -175.482 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 120.613 0.244 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -72.33 -14.63 61.79 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -173.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 103' ' ' GLU . . . . . 0.422 ' H ' ' CD ' ' B' ' 103' ' ' GLU . 2.2 mp0 -53.97 -32.24 53.31 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 111.803 0.298 . . . . 0.0 111.803 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -65.21 -38.78 91.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.954 0.407 . . . . 0.0 110.723 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 105' ' ' PHE . . . . . 0.469 ' O ' ' HE1' ' A' ' 35' ' ' PHE . 82.5 t80 -66.4 -27.66 68.02 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.785 -178.396 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 106' ' ' PHE . . . . . 0.582 ' HB3' ' CE2' ' A' ' 52' ' ' PHE . 65.1 m-85 -88.97 -33.99 17.02 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.95 0.405 . . . . 0.0 111.332 -177.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -89.45 -43.9 10.53 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -173.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -68.98 -44.75 72.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.787 0.327 . . . . 0.0 111.061 -175.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.58 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 8.8 mp -72.65 -4.57 31.84 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.474 -176.43 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 110' ' ' PHE . . . . . 0.503 ' CE1' ' HG2' ' A' ' 56' ' ' LYS . 4.5 t80 -104.68 -4.09 22.88 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.926 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -61.58 -64.3 0.99 Allowed 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.378 -177.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 3.0 p . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.75 -0.643 . . . . 0.0 110.906 -179.644 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.127 0 CA-C-O 120.418 0.151 . . . . 0.0 111.385 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 56.32 54.28 7.85 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.164 0.506 . . . . 0.0 110.757 -179.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.84 ' HA ' ' HA2' ' A' ' 57' ' ' GLY . 2.9 p -85.62 12.82 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 176.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.8 tp -56.47 108.8 1.33 Allowed Pre-proline 0 C--O 1.232 0.178 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.906 -175.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -50.49 105.72 0.11 Allowed 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 123.589 2.86 . . . . 0.0 112.911 -179.18 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.589 ' HB2' HD23 ' A' ' 28' ' ' LEU . 61.6 mtp180 -137.19 128.75 28.51 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.495 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.634 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 32.0 mt-10 -56.92 -35.75 39.06 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -176.391 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.634 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 4.3 Cg_endo -49.64 -29.76 20.25 Favored 'Trans proline' 0 C--N 1.358 1.079 0 C-N-CA 122.197 1.931 . . . . 0.0 112.996 172.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.589 HD23 ' HB2' ' A' ' 25' ' ' ARG . 4.3 mm? -66.08 -30.97 71.57 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.758 0.313 . . . . 0.0 110.764 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.415 ' O ' HG23 ' A' ' 33' ' ' VAL . 44.9 mm -62.39 -42.95 97.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.868 177.084 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.3 -46.27 84.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.15 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.6 m -61.73 -41.73 98.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.934 0.397 . . . . 0.0 110.483 177.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.548 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -63.59 -45.3 91.01 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.77 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.443 HG13 HE21 ' A' ' 37' ' ' GLN . 72.3 t -63.88 -39.97 87.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.664 0.269 . . . . 0.0 110.764 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.437 ' HE2' ' O ' ' B' ' 109' ' ' LEU . 0.8 OUTLIER -55.83 -50.5 70.37 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.199 0.524 . . . . 0.0 110.219 174.754 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.424 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 84.4 t80 -59.82 -56.25 24.06 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.638 178.531 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.548 HD13 ' O ' ' A' ' 32' ' ' ALA . 1.8 mp -50.78 -57.74 7.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.985 -1.007 . . . . 0.0 112.565 -177.088 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.443 HE21 HG13 ' A' ' 33' ' ' VAL . 35.3 mt-30 -95.28 32.64 1.7 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.641 -171.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -70.1 -63.08 1.15 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 173.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.8 p -167.57 -68.17 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.513 -178.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -96.62 -15.25 21.63 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -171.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.465 ' HB ' ' O ' ' A' ' 36' ' ' LEU . 85.6 t -59.78 -43.44 91.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 112.81 0.671 . . . . 0.0 112.81 -171.526 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.424 ' HD3' ' HG2' ' A' ' 37' ' ' GLN . 60.1 mtm180 -68.07 -19.03 64.83 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.126 -178.128 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -92.86 -15.92 25.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.253 0.549 . . . . 0.0 110.456 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 31.0 m -72.24 152.41 92.36 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.119 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -43.31 124.99 4.26 Favored 'Trans proline' 0 C--O 1.237 0.44 0 C-N-CA 123.731 2.954 . . . . 0.0 113.012 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.619 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 5.7 mp -69.28 -33.06 72.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.284 -178.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -55.76 -43.93 77.18 Favored 'General case' 0 C--O 1.234 0.24 0 O-C-N 123.444 0.465 . . . . 0.0 110.632 176.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.514 HG21 ' CZ ' ' B' ' 106' ' ' PHE . 99.9 m -55.97 -52.41 64.27 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.146 173.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.685 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 61.6 mtm180 -65.28 -21.49 66.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.487 -175.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.619 ' HG2' ' O ' ' A' ' 46' ' ' LEU . 32.5 mmt180 -66.56 -61.0 2.21 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 175.324 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.416 ' O ' ' HG2' ' A' ' 55' ' ' LYS . . . -59.87 -42.94 94.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.022 177.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.674 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 80.2 t80 -49.48 -61.08 2.3 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.985 178.002 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.776 ' HG ' HG13 ' A' ' 63' ' ' ILE . 2.8 mm? -53.12 -42.63 66.21 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -177.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.489 ' HD3' ' O ' ' A' ' 50' ' ' ARG . 1.7 mptm? -67.46 -36.82 81.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.858 0.361 . . . . 0.0 111.136 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 51' ' ' ALA . 13.7 mmmm -78.2 -23.51 47.5 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.143 -0.481 . . . . 0.0 112.078 -177.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.674 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 19.7 mmmt -79.64 -29.11 40.9 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.922 -178.062 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.84 ' HA2' ' HA ' ' A' ' 22' ' ' VAL . . . 128.39 37.98 0.39 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.84 178.035 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.7 mp -130.12 132.45 46.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.829 0.347 . . . . 0.0 110.35 177.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 20.8 p -79.03 176.94 9.19 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.604 176.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.479 ' HA ' HG22 ' A' ' 63' ' ' ILE . 8.4 m-20 -59.59 -38.53 81.45 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 -174.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.451 ' HG3' ' HG3' ' A' ' 62' ' ' GLU . 8.5 pt-20 -65.42 -33.33 75.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.262 0.553 . . . . 0.0 110.792 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.451 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 45.3 mt-10 -79.87 -37.03 35.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.627 -176.769 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.776 HG13 ' HG ' ' A' ' 53' ' ' LEU . 4.6 tt -64.08 -42.74 96.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.953 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.686 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 4.2 p30 -77.98 -19.43 54.5 Favored 'General case' 0 C--O 1.205 -1.274 0 C-N-CA 118.684 -1.207 . . . . 0.0 110.649 174.649 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.634 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 0.5 OUTLIER -61.91 -47.33 85.43 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.674 173.935 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.94 -41.12 64.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.921 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.685 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.1 m-85 -73.03 -31.64 64.57 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -178.731 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.686 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 4.2 tp-100 -67.0 -47.81 70.36 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -70.32 -31.27 68.51 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.755 -177.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 12.5 p -73.86 -9.14 58.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.747 0.308 . . . . 0.0 111.269 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 84.46 27.27 36.48 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.917 -0.659 . . . . 0.0 113.404 173.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 69.7 p -78.54 -73.04 0.34 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 177.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 52.8 42.25 31.84 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.124 0.488 . . . . 0.0 112.052 174.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -90.02 -45.49 9.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.395 177.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -160.9 173.65 14.99 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.211 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 . . . . . 0 C--N 1.324 -0.508 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.493 -177.626 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 11.8 p . . . . . 0 N--CA 1.477 0.899 0 CA-C-O 121.276 0.56 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -67.69 -51.5 48.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.851 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -59.68 -44.18 93.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.129 0.49 . . . . 0.0 110.642 -176.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -60.85 -31.06 70.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.825 -179.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -73.07 -34.91 66.53 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.443 -179.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 106' ' ' PHE . . . . . 0.514 ' CZ ' HG21 ' A' ' 48' ' ' THR . 24.7 m-85 -80.37 -20.73 43.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.762 -175.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -98.16 -62.73 1.2 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.701 0.286 . . . . 0.0 111.375 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -64.38 -36.02 82.79 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -170.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.437 ' O ' ' HE2' ' A' ' 34' ' ' LYS . 0.5 OUTLIER -79.99 -4.85 54.3 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.872 0.367 . . . . 0.0 110.887 -173.93 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 110' ' ' PHE . . . . . 0.566 ' CE1' ' HB3' ' A' ' 56' ' ' LYS . 12.9 t80 -100.34 -4.66 28.71 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.847 0.356 . . . . 0.0 110.721 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -56.68 -52.15 66.03 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.861 -178.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 7.4 t . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.121 -0.942 . . . . 0.0 109.221 -178.804 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.422 ' OE2' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.267 0 CA-C-O 120.66 0.267 . . . . 0.0 111.526 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 18.0 m120 73.05 0.83 3.82 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.188 -176.655 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.422 HG23 ' OE2' ' A' ' 20' ' ' GLU . 7.2 t 41.55 78.99 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 114.887 -1.051 . . . . 0.0 112.905 173.335 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.449 ' HA ' ' HD2' ' A' ' 24' ' ' PRO . 4.3 mm? -97.75 108.2 44.41 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.109 174.1 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.449 ' HD2' ' HA ' ' A' ' 23' ' ' LEU . 24.4 Cg_endo -61.79 83.14 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.954 2.436 . . . . 0.0 111.711 177.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.451 HH21 HD22 ' A' ' 28' ' ' LEU . 88.4 mtm180 -105.06 133.72 49.37 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.621 -176.01 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.541 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 38.8 mt-10 -65.34 -45.21 70.11 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.078 -0.965 . . . . 0.0 112.297 -177.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 19.5 Cg_endo -62.69 -22.97 74.46 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 121.923 1.749 . . . . 0.0 112.268 175.355 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.451 HD22 HH21 ' A' ' 25' ' ' ARG . 38.8 tp -71.71 -33.11 68.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.9 178.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.526 ' O ' HG23 ' A' ' 33' ' ' VAL . 66.1 mt -62.19 -45.43 98.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 174.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.63 -29.37 70.62 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.651 177.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.439 ' HB ' ' O ' ' A' ' 28' ' ' LEU . 55.3 m -66.6 -43.55 84.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.464 174.328 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.562 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -62.41 -44.57 96.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.578 178.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 29' ' ' ILE . 40.3 t -61.46 -43.66 97.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.321 178.488 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.429 ' HE2' ' HB3' ' A' ' 34' ' ' LYS . 3.3 tmmm? -53.27 -51.4 62.39 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.333 0.587 . . . . 0.0 110.359 174.666 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.422 ' CD2' HG11 ' A' ' 41' ' ' VAL . 85.4 t80 -55.76 -52.12 65.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.422 178.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.605 HD21 ' CD1' ' A' ' 67' ' ' PHE . 5.4 mp -58.01 -51.72 68.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.188 -0.915 . . . . 0.0 113.159 -176.246 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -79.93 34.54 0.29 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -167.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -100.79 29.26 4.64 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 168.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.0 m 72.31 -65.85 0.33 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 114.624 -1.171 . . . . 0.0 112.078 176.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.8 mtp180 -57.0 -44.27 82.58 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -175.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.452 ' CG1' ' HA ' ' A' ' 36' ' ' LEU . 47.3 t -62.0 -39.29 83.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.844 -174.272 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 36' ' ' LEU . 55.7 mtm180 -70.37 -13.01 61.96 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.932 -178.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.2 mm-40 -115.59 8.74 15.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.36 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 97.5 p -87.39 154.92 54.34 Favored Pre-proline 0 C--N 1.329 -0.294 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -49.18 116.58 2.31 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.869 2.38 . . . . 0.0 113.027 -178.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.506 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 23.2 mt -58.14 -27.9 64.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.343 177.481 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.82 -42.45 71.91 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.94 0.4 . . . . 0.0 110.812 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 99.7 m -70.41 -49.82 44.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.216 175.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.826 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 61.0 mtm180 -62.23 -26.42 68.36 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.514 -173.115 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.55 ' NH1' HD11 ' A' ' 63' ' ' ILE . 22.6 mmm180 -61.21 -61.96 2.19 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.932 0.396 . . . . 0.0 110.61 176.11 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.71 -32.2 73.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.201 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.67 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 91.6 t80 -54.93 -55.81 26.53 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.862 177.363 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.926 HD12 ' HB ' ' A' ' 63' ' ' ILE . 19.6 mt -59.55 -44.67 93.17 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.077 0.236 . . . . 0.0 111.026 -177.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 1.109 ' HE2' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -58.51 -44.44 89.47 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.94 0.4 . . . . 0.0 111.032 -179.577 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.443 ' HA ' ' HD3' ' A' ' 55' ' ' LYS . 31.4 mmtp -70.35 -21.38 62.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.584 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.909 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -73.29 -21.63 60.55 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 121.07 -0.252 . . . . 0.0 111.109 179.07 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.05 32.67 1.49 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.399 -0.905 . . . . 0.0 114.211 173.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.765 HD11 ' HB3' ' A' ' 53' ' ' LEU . 1.4 pp -139.37 142.53 37.55 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 117.479 0.639 . . . . 0.0 110.711 175.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.433 ' O ' HG23 ' A' ' 63' ' ' ILE . 1.1 p -70.19 161.89 29.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.828 -0.624 . . . . 0.0 112.524 -172.242 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.592 ' O ' HG12 ' A' ' 63' ' ' ILE . 6.3 t70 -50.04 -49.13 52.11 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.093 0.557 . . . . 0.0 111.57 -174.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.496 ' HG3' ' HG2' ' A' ' 62' ' ' GLU . 9.4 pt-20 -53.01 -38.69 62.55 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.677 178.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.496 ' HG2' ' HG3' ' A' ' 61' ' ' GLU . 4.7 mm-40 -78.41 -26.51 46.44 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.752 -175.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 1.109 HD13 ' HE2' ' A' ' 54' ' ' LYS . 1.7 pt -67.4 -38.66 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.872 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.663 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 0.3 OUTLIER -75.33 -27.99 59.46 Favored 'General case' 0 C--O 1.212 -0.871 0 C-N-CA 119.801 -0.76 . . . . 0.0 109.246 177.539 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.468 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 2.0 tpt -61.26 -48.49 81.17 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 176.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.62 -47.22 73.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.911 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.826 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 1.4 m-85 -64.62 -37.46 87.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.593 -179.67 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.663 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 16.6 tm0? -60.62 -53.92 51.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.749 0.785 . . . . 0.0 109.237 177.427 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -62.35 -35.09 78.05 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 113.982 -1.463 . . . . 0.0 111.805 -175.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 24.2 m -82.15 -5.33 58.38 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -176.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.74 61.48 6.16 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.054 -0.593 . . . . 0.0 111.777 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 39.9 p -133.02 2.11 3.61 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -172.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -114.54 132.12 56.42 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.778 0.323 . . . . 0.0 110.709 -176.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.53 -37.55 78.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.532 0.682 . . . . 0.0 109.452 174.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -161.45 -46.57 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 173.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 . . . . . 0 C--N 1.326 -0.434 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.038 172.318 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 13.4 p . . . . . 0 N--CA 1.476 0.842 0 N-CA-C 110.634 -0.136 . . . . 0.0 110.634 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -53.98 -41.57 68.01 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -174.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -60.82 -55.4 33.54 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.638 0.236 . . . . 0.0 111.638 -177.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 34.6 mttp -59.65 -33.87 72.09 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.013 0.435 . . . . 0.0 111.232 179.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -76.54 -22.26 54.6 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 120.739 -0.385 . . . . 0.0 111.053 -178.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 106' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -96.55 -32.1 12.43 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 119.798 -0.761 . . . . 0.0 111.477 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -98.36 -48.77 4.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.88 0.372 . . . . 0.0 111.859 -177.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -80.88 -32.0 35.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.445 -172.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.419 HD13 ' O ' ' B' ' 109' ' ' LEU . 1.9 tm? -58.77 -31.53 68.46 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.133 0.492 . . . . 0.0 109.855 179.076 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 110' ' ' PHE . . . . . 0.552 ' CD1' ' HD3' ' A' ' 56' ' ' LYS . 53.5 t80 -64.81 -53.91 39.4 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.829 -178.467 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -50.08 -65.77 0.51 Allowed 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.414 0.446 . . . . 0.0 111.707 -173.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 26.8 m . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.852 -0.594 . . . . 0.0 110.511 -178.658 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 . . . . . 0 CA--C 1.53 0.202 0 CA-C-O 120.853 0.358 . . . . 0.0 111.419 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 23.9 p30 -107.4 -4.05 18.95 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.835 -175.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.575 ' O ' ' HD3' ' A' ' 24' ' ' PRO . 35.5 m -92.12 95.83 5.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.897 0.856 . . . . 0.0 110.493 178.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.451 ' O ' HD21 ' A' ' 28' ' ' LEU . 92.4 mt -99.14 102.54 16.03 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.681 175.143 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.575 ' HD3' ' O ' ' A' ' 22' ' ' VAL . 31.8 Cg_exo -63.36 86.71 0.13 Allowed 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 123.043 2.495 . . . . 0.0 111.824 176.359 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.445 ' O ' HG13 ' A' ' 29' ' ' ILE . 99.2 mtt180 -127.35 165.17 20.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.836 -176.373 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.638 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 44.0 mt-10 -75.94 -42.07 3.51 Favored Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -175.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.638 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 4.9 Cg_endo -48.31 -43.93 30.65 Favored 'Trans proline' 0 C--N 1.358 1.058 0 C-N-CA 122.734 2.289 . . . . 0.0 113.513 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.564 HD12 ' N ' ' A' ' 29' ' ' ILE . 2.3 pp -77.05 -25.96 53.07 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.529 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.564 ' N ' HD12 ' A' ' 28' ' ' LEU . 82.9 mt -65.84 -49.07 79.62 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 N-CA-C 109.389 -0.596 . . . . 0.0 109.389 174.107 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.44 -40.08 81.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.508 177.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 34.5 m -64.85 -40.78 95.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.612 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.435 ' O ' HD23 ' A' ' 36' ' ' LEU . . . -67.0 -39.36 87.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.242 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 29' ' ' ILE . 90.8 t -62.58 -49.12 85.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.693 -0.231 . . . . 0.0 110.878 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.524 ' HD2' ' N ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -67.71 -32.75 73.6 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.028 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.529 ' CE2' HG11 ' A' ' 41' ' ' VAL . 89.7 t80 -59.15 -53.35 59.3 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.078 177.61 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.729 HD13 HG12 ' A' ' 41' ' ' VAL . 3.4 mm? -58.79 -49.05 79.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.277 -178.204 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -92.17 6.89 44.95 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -172.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.413 ' HB2' ' O ' ' A' ' 34' ' ' LYS . 5.0 t30 -60.67 -45.73 93.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.639 0.257 . . . . 0.0 110.778 -177.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.573 ' HB2' ' HZ ' ' B' ' 105' ' ' PHE . 14.7 m -156.5 -67.05 0.11 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.865 0.365 . . . . 0.0 111.294 -176.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.462 ' HA ' ' NE2' ' A' ' 43' ' ' GLN . 5.3 ptp180 -132.46 -8.83 3.28 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -170.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.729 HG12 HD13 ' A' ' 36' ' ' LEU . 58.3 t -57.51 -40.27 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -172.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.762 ' HG3' HG22 ' A' ' 72' ' ' THR . 33.8 ttp180 -66.08 -21.0 66.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.834 0.349 . . . . 0.0 110.326 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.462 ' NE2' ' HA ' ' A' ' 40' ' ' ARG . 0.5 OUTLIER -97.74 -5.46 34.99 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.488 176.332 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.2 m -83.06 156.59 66.87 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.021 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -45.47 126.2 8.28 Favored 'Trans proline' 0 C--O 1.241 0.645 0 C-N-CA 123.8 3.0 . . . . 0.0 113.665 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.819 HD22 ' HB3' ' A' ' 75' ' ' ASP . 6.1 mp -66.66 -24.13 66.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.556 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.46 -44.68 85.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.665 176.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.415 HG21 ' CZ ' ' B' ' 106' ' ' PHE . 84.8 m -64.6 -50.34 67.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.318 176.229 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.73 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 15.6 mtm180 -65.4 -31.36 72.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.215 -172.257 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.409 ' HA ' HD11 ' A' ' 63' ' ' ILE . 1.1 mtt-85 -66.4 -52.54 45.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.708 0.29 . . . . 0.0 111.045 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.7 -40.18 96.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.052 0.453 . . . . 0.0 109.958 176.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.801 ' HD1' HD12 ' A' ' 53' ' ' LEU . 77.0 t80 -51.73 -68.56 0.16 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.961 -1.018 . . . . 0.0 111.376 177.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.801 HD12 ' HD1' ' A' ' 52' ' ' PHE . 9.8 mp -57.1 -36.22 70.35 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -175.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.45 -36.12 81.99 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.901 178.246 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -77.26 -23.66 51.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.872 0.368 . . . . 0.0 111.302 176.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.671 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 19.8 mmmt -77.28 -14.5 59.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.522 -178.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.45 ' HA2' ' HA ' ' A' ' 22' ' ' VAL . . . 116.0 22.81 4.46 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.58 -0.819 . . . . 0.0 113.179 176.377 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.504 ' HG ' HD13 ' A' ' 28' ' ' LEU . 5.7 mp -108.13 140.77 40.83 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.933 0.367 . . . . 0.0 110.739 177.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.8 p -84.43 174.02 10.41 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.834 172.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.578 ' HA ' HG22 ' A' ' 63' ' ' ILE . 0.4 OUTLIER -59.97 -40.89 90.61 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 -178.726 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -59.91 -40.34 88.52 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.289 0.566 . . . . 0.0 110.551 177.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -79.37 -28.04 41.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.146 -174.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.698 HG13 HD22 ' A' ' 53' ' ' LEU . 9.9 tt -69.53 -40.01 79.14 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.778 -178.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.624 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 0.4 OUTLIER -67.73 -40.52 84.19 Favored 'General case' 0 C--O 1.207 -1.149 0 C-N-CA 119.034 -1.066 . . . . 0.0 108.254 174.701 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.518 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 1.4 tpt -56.11 -42.77 77.36 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 120.958 0.409 . . . . 0.0 111.134 -177.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.44 -44.64 70.87 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.975 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.73 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.6 m-85 -69.43 -29.32 67.01 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.624 ' HG2' ' O ' ' A' ' 64' ' ' ASP . 69.6 mm-40 -62.88 -52.7 62.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.306 0.574 . . . . 0.0 109.757 178.14 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -67.92 -28.55 67.59 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.921 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.1 t -75.47 -10.01 59.07 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.203 0.525 . . . . 0.0 111.408 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 67.88 43.31 83.67 Favored Glycine 0 N--CA 1.451 -0.357 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.597 176.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.762 HG22 ' HG3' ' A' ' 42' ' ' ARG . 22.0 p -77.04 -64.72 1.07 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.535 0.207 . . . . 0.0 110.745 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 51.41 60.2 4.03 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.586 173.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -127.07 -60.8 1.19 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.839 177.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.819 ' HB3' HD22 ' A' ' 46' ' ' LEU . 32.2 t70 -137.57 145.31 42.7 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 174.018 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 . . . . . 0 C--N 1.322 -0.592 0 CA-C-O 120.882 0.372 . . . . 0.0 110.668 -174.945 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 30.0 t . . . . . 0 N--CA 1.481 1.11 0 CA-C-O 120.858 0.361 . . . . 0.0 111.289 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 29.9 mm-40 -73.04 -18.46 61.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.428 -172.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -59.84 -32.0 70.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.059 0.457 . . . . 0.0 110.564 175.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 46.9 mtpt -75.37 -9.81 58.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.536 -178.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 105' ' ' PHE . . . . . 0.573 ' HZ ' ' HB2' ' A' ' 39' ' ' SER . 39.0 t80 -68.21 -27.47 66.41 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.801 0.334 . . . . 0.0 110.237 -178.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 106' ' ' PHE . . . . . 0.453 ' CD2' ' HZ ' ' A' ' 35' ' ' PHE . 60.6 m-85 -87.61 -23.73 24.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.162 0.506 . . . . 0.0 110.812 176.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -93.46 -64.78 1.05 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.589 -174.021 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -64.64 -22.04 66.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.61 -170.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.508 HD13 ' HA ' ' B' ' 105' ' ' PHE . 10.6 mp -82.72 -10.74 58.77 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.896 -0.322 . . . . 0.0 111.523 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 110' ' ' PHE . . . . . 0.54 ' CE1' ' HB3' ' A' ' 56' ' ' LYS . 2.7 t80 -101.39 -11.88 19.04 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 119.497 -0.881 . . . . 0.0 110.841 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -71.85 -71.93 0.25 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 173.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 52.0 m . . . . . 0 C--O 1.247 0.951 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.651 172.86 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 . . . . . 0 C--O 1.233 0.231 0 CA-C-O 120.943 0.401 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 177.14 -38.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.005 -175.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.844 ' HB ' ' HA ' ' A' ' 59' ' ' THR . 34.7 m -82.94 118.01 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.171 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.583 ' HG ' ' HG2' ' A' ' 25' ' ' ARG . 39.8 tp -99.56 109.02 53.75 Favored Pre-proline 0 C--N 1.318 -0.803 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.663 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.542 ' HA ' ' OE2' ' A' ' 62' ' ' GLU . 14.4 Cg_exo -70.16 91.63 0.55 Allowed 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.822 2.348 . . . . 0.0 112.209 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.583 ' HG2' ' HG ' ' A' ' 23' ' ' LEU . 40.6 mmt180 -143.12 123.86 14.17 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.468 -178.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.649 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 0.5 OUTLIER -67.01 -40.7 30.87 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.374 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.649 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 9.4 Cg_endo -53.22 -35.63 74.49 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 122.145 1.897 . . . . 0.0 112.414 175.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.478 HD22 ' HB2' ' A' ' 58' ' ' LEU . 4.3 tt -76.13 -28.87 57.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.896 0.379 . . . . 0.0 110.027 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.507 HG12 HD11 ' A' ' 58' ' ' LEU . 70.7 mt -60.03 -41.84 87.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 172.215 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.71 -40.06 95.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.548 176.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.1 m -58.97 -41.07 86.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.3 0.571 . . . . 0.0 110.199 175.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.588 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -67.4 -45.12 77.09 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.076 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 29' ' ' ILE . 73.8 t -62.12 -45.26 99.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -177.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.62 -29.06 69.0 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.108 0.48 . . . . 0.0 110.237 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.491 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 79.9 t80 -66.19 -57.94 6.51 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.414 -0.812 . . . . 0.0 108.995 173.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.588 HD13 ' O ' ' A' ' 32' ' ' ALA . 1.2 mp -50.49 -56.86 9.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.541 -1.209 . . . . 0.0 112.127 -178.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.539 ' HG2' ' HD3' ' A' ' 42' ' ' ARG . 49.4 mt-30 -83.8 34.38 0.49 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -173.495 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -93.0 25.68 3.12 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 166.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.1 t 73.32 -64.15 0.41 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-N 114.767 -1.106 . . . . 0.0 111.724 178.06 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -65.53 -23.03 66.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.009 -172.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.487 ' HB ' ' O ' ' A' ' 36' ' ' LEU . 51.8 t -80.57 -37.74 17.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.245 -179.297 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.539 ' HD3' ' HG2' ' A' ' 37' ' ' GLN . 25.8 mtm180 -66.23 -22.7 66.34 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.225 -0.59 . . . . 0.0 109.689 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -99.46 9.92 42.36 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.761 174.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 28.0 t -91.53 142.41 26.84 Favored Pre-proline 0 C--N 1.326 -0.441 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 176.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.417 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 9.6 Cg_endo -49.91 128.39 21.71 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 123.547 2.832 . . . . 0.0 112.695 -178.317 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.518 ' O ' ' HG3' ' A' ' 50' ' ' ARG . 7.5 mp -60.93 -30.13 70.03 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.753 -178.427 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -51.23 -46.53 62.3 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 123.638 0.586 . . . . 0.0 110.787 176.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.503 HG21 ' CZ ' ' B' ' 106' ' ' PHE . 98.4 m -70.51 -53.31 16.71 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.358 176.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.501 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 16.7 mtm180 -55.39 -44.89 76.54 Favored 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.646 0.591 . . . . 0.0 112.235 -171.378 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.579 ' O ' ' HD3' ' A' ' 54' ' ' LYS . 67.1 mtm180 -63.16 -54.86 31.09 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.85 -176.049 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.493 ' O ' ' HG2' ' A' ' 55' ' ' LYS . . . -60.48 -43.46 96.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.953 0.406 . . . . 0.0 110.357 178.319 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.669 ' HD1' HD12 ' A' ' 53' ' ' LEU . 72.2 t80 -49.6 -57.6 6.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.727 178.031 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.669 HD12 ' HD1' ' A' ' 52' ' ' PHE . 8.6 mp -57.67 -43.99 85.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.717 -0.22 . . . . 0.0 111.38 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.847 ' HE3' HD13 ' A' ' 63' ' ' ILE . 2.2 mptm? -61.64 -46.68 88.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.777 0.322 . . . . 0.0 110.983 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 51' ' ' ALA . 14.5 mmmm -72.23 -23.87 61.3 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.9 -173.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.768 ' HE2' ' HA ' ' A' ' 56' ' ' LYS . 10.3 mmpt? -74.59 -19.2 60.41 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.767 0.317 . . . . 0.0 110.413 177.181 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.25 51.68 0.35 Allowed Glycine 0 N--CA 1.444 -0.776 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.444 177.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.572 HD23 HG22 ' A' ' 63' ' ' ILE . 22.8 tp -142.19 141.32 32.57 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -179.222 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.844 ' HA ' ' HB ' ' A' ' 22' ' ' VAL . 1.2 m -76.18 157.02 33.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.713 -178.216 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.764 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 23.0 p-10 -60.75 -45.87 92.65 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -178.148 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.66 ' HG3' ' HG3' ' A' ' 62' ' ' GLU . 7.3 pt-20 -52.61 -37.52 58.46 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.699 0.762 . . . . 0.0 111.104 177.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.66 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 47.5 mt-10 -78.91 -27.3 43.78 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.915 -174.227 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.847 HD13 ' HE3' ' A' ' 54' ' ' LYS . 3.7 pt -70.51 -34.6 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.177 177.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.524 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 0.6 OUTLIER -68.44 -31.79 71.36 Favored 'General case' 0 C--O 1.209 -1.066 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 176.304 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 37.9 tpp -66.97 -42.68 84.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.843 0.354 . . . . 0.0 110.324 177.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.91 -47.46 83.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.151 176.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.501 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 6.9 m-85 -66.49 -31.68 72.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.0 177.233 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.524 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 24.8 tm0? -65.06 -49.74 68.89 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.314 0.578 . . . . 0.0 109.601 -179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -67.22 -30.88 70.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.048 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 32.4 m -83.37 7.74 15.75 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.492 -178.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 61.38 36.89 93.19 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 116.12 -0.491 . . . . 0.0 112.357 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.9 p -130.84 40.9 3.43 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.036 0.446 . . . . 0.0 111.341 -175.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.2 53.37 2.24 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.511 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -83.57 115.02 21.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.576 178.005 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.4 t70 64.44 -159.68 0.29 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 -174.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 . . . . . 0 C--N 1.319 -0.748 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.963 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 44.7 m . . . . . 0 N--CA 1.475 0.81 0 CA-C-O 121.013 0.435 . . . . 0.0 110.438 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -96.87 -39.18 9.53 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.974 -177.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 103' ' ' GLU . . . . . 0.463 ' HA ' ' HD1' ' B' ' 106' ' ' PHE . 42.9 mt-10 -61.76 -29.26 70.01 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -170.016 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -61.57 -32.89 73.0 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.065 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -75.85 -17.38 59.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.8 0.333 . . . . 0.0 110.216 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 106' ' ' PHE . . . . . 0.565 ' HB3' ' CE2' ' A' ' 52' ' ' PHE . 56.4 m-85 -95.22 -18.61 20.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.4 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -97.8 -62.86 1.19 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.144 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -57.24 -48.02 79.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.18 0.514 . . . . 0.0 110.691 -175.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.489 HD13 ' O ' ' B' ' 109' ' ' LEU . 0.5 OUTLIER -70.91 -22.67 62.22 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.65 -176.089 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 110' ' ' PHE . . . . . 0.44 ' HE2' ' HA ' ' A' ' 32' ' ' ALA . 51.1 t80 -93.08 -43.33 8.93 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.078 -178.001 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -57.24 -43.47 82.96 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.26 -176.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 C--O 1.245 0.837 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.143 176.011 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.422 ' HG2' ' H ' ' A' ' 21' ' ' ASN . 0.9 OUTLIER . . . . . 0 C--O 1.234 0.269 0 CA-C-O 121.346 0.593 . . . . 0.0 110.877 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.422 ' H ' ' HG2' ' A' ' 20' ' ' GLU . 27.7 p-10 -176.87 -171.51 0.37 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.866 -1.061 . . . . 0.0 108.138 177.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.736 HG13 ' HA ' ' A' ' 59' ' ' THR . 45.3 t 61.11 54.78 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-O 122.022 0.915 . . . . 0.0 110.298 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.409 ' O ' ' HG3' ' A' ' 25' ' ' ARG . 2.4 tt -99.76 111.05 60.99 Favored Pre-proline 0 C--N 1.318 -0.764 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.708 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 52.4 Cg_exo -56.59 98.14 0.07 OUTLIER 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.91 2.406 . . . . 0.0 112.599 -178.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 23' ' ' LEU . 82.4 mtp180 -128.42 95.95 4.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.632 -176.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.607 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 34.6 tt0 -56.32 -42.99 99.02 Favored Pre-proline 0 CA--C 1.541 0.616 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.607 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 9.0 Cg_endo -52.63 -30.08 44.02 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 122.033 1.822 . . . . 0.0 112.537 176.442 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.649 HD22 HD13 ' A' ' 58' ' ' LEU . 7.1 tt -71.17 -22.0 62.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.416 -178.328 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.673 HD11 ' HB3' ' A' ' 62' ' ' GLU . 47.4 mm -58.74 -46.53 90.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.723 0.297 . . . . 0.0 110.349 176.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.12 -44.59 95.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.103 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 34.7 m -57.44 -38.3 74.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.723 176.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.787 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -68.99 -48.81 62.19 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.389 -179.027 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 29' ' ' ILE . 89.1 t -59.47 -45.57 93.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 111.422 0.156 . . . . 0.0 111.422 -177.647 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.593 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 0.0 OUTLIER -69.27 -23.74 63.88 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.888 0.375 . . . . 0.0 110.584 179.404 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.525 ' HZ ' ' CD2' ' B' ' 106' ' ' PHE . 86.5 t80 -70.48 -54.66 11.38 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.389 -0.596 . . . . 0.0 109.389 174.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.787 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 33.3 mt -57.01 -55.52 33.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.427 -176.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -95.17 28.11 2.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.137 -175.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' A' ' 34' ' ' LYS . 15.5 t-20 -68.84 -50.6 48.6 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 173.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.4 p -173.49 -68.08 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.414 176.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 55.8 mtp180 -95.41 -20.22 19.27 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -169.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.525 HG23 ' HE2' ' B' ' 105' ' ' PHE . 48.9 t -63.86 -34.97 71.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 CA-C-N 118.022 0.374 . . . . 0.0 111.498 -174.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.413 ' HD2' HG21 ' A' ' 72' ' ' THR . 6.6 mmm180 -58.3 -29.85 66.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.882 0.373 . . . . 0.0 110.769 174.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -99.02 -5.19 30.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.521 -177.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 51.0 m -80.93 146.77 60.15 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.229 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.403 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 54.1 Cg_exo -52.19 134.24 49.82 Favored 'Trans proline' 0 C--O 1.239 0.528 0 C-N-CA 123.023 2.482 . . . . 0.0 112.794 -178.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.464 ' O ' ' HG3' ' A' ' 50' ' ' ARG . 7.8 mp -64.07 -28.02 69.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.35 -175.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.17 -50.87 71.49 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.366 0.416 . . . . 0.0 110.528 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 98.9 m -57.42 -56.12 25.9 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.809 174.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.64 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 30.7 mtm180 -56.13 -43.49 78.24 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -170.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 66.4 mtm180 -69.24 -48.48 61.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.591 0.234 . . . . 0.0 111.441 -174.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.452 ' O ' ' HG3' ' A' ' 55' ' ' LYS . . . -64.83 -38.29 90.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.258 0.551 . . . . 0.0 109.787 177.105 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.613 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 55.3 t80 -48.96 -67.56 0.26 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.735 -1.12 . . . . 0.0 112.393 179.519 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 49' ' ' ARG . 0.4 OUTLIER -68.11 -29.98 69.03 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -174.523 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.874 ' HE2' HD13 ' A' ' 63' ' ' ILE . 59.0 mttm -59.14 -42.12 89.92 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.112 0.482 . . . . 0.0 110.224 173.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 51' ' ' ALA . 28.8 mtpp -74.94 -30.64 61.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.395 -178.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.613 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 11.4 mmpt? -64.42 -27.13 68.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.356 0.598 . . . . 0.0 109.966 176.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 127.57 65.92 0.14 Allowed Glycine 0 N--CA 1.443 -0.881 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.182 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.715 ' HG ' ' HB2' ' A' ' 62' ' ' GLU . 11.8 tp -151.23 144.51 24.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.002 0.43 . . . . 0.0 110.511 -178.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.736 ' HA ' HG13 ' A' ' 22' ' ' VAL . 2.7 m -87.94 166.51 14.46 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.97 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.58 ' O ' HG12 ' A' ' 63' ' ' ILE . 4.6 m-20 -50.77 -57.7 7.72 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 122.88 0.472 . . . . 0.0 111.779 178.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.442 ' HA ' ' OD2' ' A' ' 64' ' ' ASP . 7.7 pt-20 -58.52 -27.63 64.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.756 -177.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.715 ' HB2' ' HG ' ' A' ' 58' ' ' LEU . 51.8 mt-10 -79.9 -28.17 39.86 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.854 -178.599 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.874 HD13 ' HE2' ' A' ' 54' ' ' LYS . 3.2 pt -70.11 -34.15 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 C-N-CA 119.952 -0.699 . . . . 0.0 109.758 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.442 ' OD2' ' HA ' ' A' ' 61' ' ' GLU . 3.0 p30 -77.3 -26.02 51.88 Favored 'General case' 0 C--O 1.21 -0.996 0 C-N-CA 119.532 -0.867 . . . . 0.0 110.223 173.299 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.642 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 0.3 OUTLIER -56.69 -50.94 70.65 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 119.599 -0.84 . . . . 0.0 108.786 173.318 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.42 -57.68 6.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.456 178.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.64 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 3.6 m-85 -66.13 -38.49 88.28 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -173.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -65.68 -45.75 81.68 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -178.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -77.24 -21.26 54.02 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.258 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 32.5 t -79.6 -14.9 58.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.67 0.271 . . . . 0.0 110.37 176.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 80.37 28.37 48.61 Favored Glycine 0 C--N 1.333 0.368 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.78 176.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.619 HG23 ' HD1' ' A' ' 67' ' ' PHE . 10.2 t -145.52 48.22 1.26 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.107 0.956 . . . . 0.0 110.467 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -91.37 -26.23 19.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.15 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 70.69 -75.91 0.07 Allowed 'General case' 0 N--CA 1.463 0.202 0 O-C-N 124.349 1.031 . . . . 0.0 111.852 177.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.415 ' HB2' ' H ' ' A' ' 76' ' ' GLU . 6.7 m-20 -124.78 -93.8 0.49 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.048 0.452 . . . . 0.0 110.773 -176.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.415 ' H ' ' HB2' ' A' ' 75' ' ' ASP . 8.5 pt-20 . . . . . 0 C--N 1.326 -0.438 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.012 -177.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 18.2 m . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 121.229 0.537 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -84.17 -49.65 8.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.913 -175.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -74.31 -31.13 62.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.877 -178.104 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -55.45 -36.95 67.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.136 0.493 . . . . 0.0 110.155 172.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 105' ' ' PHE . . . . . 0.525 ' HE2' HG23 ' A' ' 41' ' ' VAL . 33.4 t80 -69.57 -42.3 74.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.66 -177.276 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 106' ' ' PHE . . . . . 0.525 ' CD2' ' HZ ' ' A' ' 35' ' ' PHE . 37.8 m-85 -75.92 -38.29 57.85 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -178.622 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.3 -60.16 2.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.238 -172.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -61.09 -49.97 75.17 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -171.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.593 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 72.6 mt -58.5 -33.96 70.4 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.735 0.302 . . . . 0.0 111.429 -176.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 110' ' ' PHE . . . . . 0.679 ' HE2' ' HA ' ' A' ' 32' ' ' ALA . 6.1 t80 -92.02 -5.95 52.01 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.212 -174.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -73.83 -23.68 59.68 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.816 -178.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.987 -0.53 . . . . 0.0 109.762 176.124 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 . . . . . 0 C--O 1.234 0.28 0 CA-C-O 120.717 0.294 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -78.25 56.32 1.67 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.467 0.651 . . . . 0.0 109.885 178.081 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.0 p -133.13 6.33 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.044 175.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . 41.3 tp -57.26 109.54 1.81 Allowed Pre-proline 0 C--O 1.233 0.232 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.611 -174.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.473 ' HA ' ' O ' ' A' ' 57' ' ' GLY . 21.5 Cg_exo -67.2 132.42 27.72 Favored 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 123.3 2.666 . . . . 0.0 111.878 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.424 ' HB2' ' HB2' ' A' ' 28' ' ' LEU . 74.4 mtt180 -119.71 160.79 21.87 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.685 179.046 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.612 ' HB2' ' HD3' ' A' ' 27' ' ' PRO . 39.4 mt-10 -66.18 -55.05 22.41 Favored Pre-proline 0 CA--C 1.539 0.527 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -174.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.612 ' HD3' ' HB2' ' A' ' 26' ' ' GLU . 86.1 Cg_endo -78.85 -16.87 12.57 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 122.083 1.855 . . . . 0.0 112.72 -175.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.424 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 3.4 tt -65.72 -30.52 71.2 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.239 -175.67 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.7 mt -64.68 -37.76 80.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.125 0.488 . . . . 0.0 110.082 175.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.477 ' HA ' HG12 ' A' ' 33' ' ' VAL . . . -70.81 -39.15 73.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.519 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.6 m -61.13 -39.48 90.2 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 121.024 0.44 . . . . 0.0 110.041 174.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.733 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -66.93 -49.13 66.47 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.436 179.454 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.477 HG12 ' HA ' ' A' ' 30' ' ' ALA . 9.8 p -64.34 -35.22 73.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.615 -178.418 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.535 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.6 tmmm? -59.09 -52.26 66.52 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 172.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.505 ' HZ ' ' CD2' ' B' ' 106' ' ' PHE . 85.9 t80 -50.95 -52.8 38.76 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.571 179.178 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.733 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 39.3 mt -59.63 -40.38 87.44 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.764 -176.106 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.407 HE21 ' HA ' ' A' ' 70' ' ' SER . 95.8 mt-30 -85.95 32.01 0.61 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -172.06 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -101.71 28.99 5.18 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.239 0.542 . . . . 0.0 109.683 170.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.3 m 70.56 -66.95 0.26 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 114.711 -1.132 . . . . 0.0 112.339 175.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -57.54 -36.12 71.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.635 -173.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.678 HG12 ' HD3' ' A' ' 49' ' ' ARG . 51.5 t -63.03 -44.62 99.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.406 -176.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.514 ' HD2' ' CG2' ' A' ' 72' ' ' THR . 32.9 mtm180 -67.35 -18.76 65.28 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.007 0.432 . . . . 0.0 110.337 -177.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 93.0 mt-30 -96.73 -0.87 47.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.682 178.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.6 m -88.22 153.18 51.17 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.289 175.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -60.97 142.37 97.32 Favored 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 122.547 2.165 . . . . 0.0 112.579 -177.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.4 mt -63.11 -23.58 67.51 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.701 177.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.6 -47.59 73.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.355 174.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 73.7 m -70.49 -59.57 2.77 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.324 174.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.897 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 41.0 mtm180 -52.94 -47.41 68.07 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -171.31 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.433 ' HG2' ' HE2' ' A' ' 67' ' ' PHE . 80.5 mtm180 -67.38 -52.74 36.39 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 121.156 -0.218 . . . . 0.0 111.46 -174.274 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.44 -34.68 78.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.148 0.499 . . . . 0.0 110.389 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.624 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 49.8 t80 -54.88 -66.41 0.41 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.143 -0.935 . . . . 0.0 112.339 179.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 49' ' ' ARG . 0.5 OUTLIER -68.07 -23.73 64.98 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.713 -173.809 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.584 ' HA ' ' O ' ' A' ' 58' ' ' LEU . 97.4 mttt -63.15 -48.62 77.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.985 0.421 . . . . 0.0 110.683 173.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -67.85 -22.39 65.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.698 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.624 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 11.4 mmpt? -69.78 -45.38 68.13 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.99 176.035 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.473 ' O ' ' HA ' ' A' ' 24' ' ' PRO . . . 150.79 62.73 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.206 -0.997 . . . . 0.0 113.724 176.542 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.59 HD11 HD13 ' A' ' 53' ' ' LEU . 3.0 pp -171.89 148.36 2.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.938 0.399 . . . . 0.0 110.75 173.221 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.625 HG22 ' H ' ' A' ' 60' ' ' ASP . 1.5 m -93.75 177.05 6.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.02 -177.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.681 ' O ' HG12 ' A' ' 63' ' ' ILE . 2.7 m-20 -49.81 -46.03 50.58 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -174.365 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 65' ' ' MET . 8.6 pt-20 -52.15 -40.29 61.2 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.163 0.506 . . . . 0.0 111.356 178.503 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.572 ' CB ' ' HB2' ' A' ' 58' ' ' LEU . 1.5 mp0 -77.45 -27.03 52.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.354 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.681 HG12 ' O ' ' A' ' 60' ' ' ASP . 2.4 pt -69.53 -39.62 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 120.269 -0.573 . . . . 0.0 110.158 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.54 -26.8 63.73 Favored 'General case' 0 C--O 1.211 -0.956 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 176.261 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.559 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 19.0 mmt -64.84 -49.9 68.76 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.227 175.272 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.72 -40.86 84.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.169 0.509 . . . . 0.0 110.365 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.897 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.8 m-85 -69.82 -28.56 65.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.194 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.3 tp60 -65.87 -50.06 65.9 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.037 0.446 . . . . 0.0 110.058 176.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -62.62 -36.94 84.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.888 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.407 ' HA ' HE21 ' A' ' 37' ' ' GLN . 32.4 p -83.86 0.23 48.48 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.572 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.91 37.19 94.28 Favored Glycine 0 C--N 1.334 0.433 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.738 177.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.514 ' CG2' ' HD2' ' A' ' 42' ' ' ARG . 35.9 p -125.15 19.33 8.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.074 0.464 . . . . 0.0 111.837 -176.042 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -77.13 71.45 3.62 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 174.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.66 -72.14 0.06 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.111 -0.95 . . . . 0.0 112.901 -173.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -129.77 -73.46 0.56 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.685 0.279 . . . . 0.0 110.443 -176.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 . . . . . 0 N--CA 1.446 -0.636 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 174.666 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 21.6 m . . . . . 0 N--CA 1.476 0.835 0 CA-C-O 120.761 0.315 . . . . 0.0 110.839 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -85.79 -31.83 22.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.839 0.352 . . . . 0.0 111.061 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -64.89 -34.25 77.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.729 0.3 . . . . 0.0 111.349 -177.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.59 ' HA ' ' HG2' ' B' ' 107' ' ' GLN . 0.1 OUTLIER -68.91 -18.75 64.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.894 179.609 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -70.78 -35.11 72.42 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.787 0.327 . . . . 0.0 110.228 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 106' ' ' PHE . . . . . 0.505 ' CD2' ' HZ ' ' A' ' 35' ' ' PHE . 12.3 m-85 -79.02 -33.48 44.8 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.526 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 107' ' ' GLN . . . . . 0.59 ' HG2' ' HA ' ' B' ' 104' ' ' LYS . 11.4 pt20 -91.65 -50.15 5.91 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -175.495 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 108' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' B' ' 107' ' ' GLN . 20.5 tt0 -78.58 -28.69 45.91 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 111.628 0.233 . . . . 0.0 111.628 -169.451 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.535 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 42.2 tp -69.66 -19.3 63.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.08 0.467 . . . . 0.0 110.161 178.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 110' ' ' PHE . . . . . 0.503 ' CE2' ' HA ' ' A' ' 32' ' ' ALA . 2.3 t80 -97.16 -5.2 37.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.855 -179.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -63.33 -52.48 61.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.385 0.612 . . . . 0.0 109.926 177.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 C--O 1.248 0.981 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.606 179.226 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 . . . . . 0 N--CA 1.458 -0.061 0 CA-C-O 121.243 0.544 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.482 ' O ' ' HA2' ' A' ' 57' ' ' GLY . 6.0 t30 -164.64 47.37 0.1 Allowed 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 175.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.6 t -119.26 59.67 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.871 -174.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 25' ' ' ARG . 1.0 OUTLIER -99.41 106.86 41.92 Favored Pre-proline 0 C--N 1.322 -0.619 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 176.676 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.544 ' HB3' ' HG2' ' A' ' 62' ' ' GLU . 28.7 Cg_endo -62.72 92.12 0.14 Allowed 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.824 2.349 . . . . 0.0 111.988 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.569 ' HB2' ' HB2' ' A' ' 28' ' ' LEU . 74.6 mtt180 -90.2 147.52 23.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.927 -177.293 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.469 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 13.2 tp10 -61.97 -53.09 62.99 Favored Pre-proline 0 CA--C 1.539 0.533 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.131 -179.305 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 26.8 Cg_endo -64.2 -20.14 66.71 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 121.993 1.796 . . . . 0.0 112.178 178.313 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.569 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 46.7 tp -67.78 -46.26 72.51 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.838 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 50.7 mm -64.12 -42.05 94.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.168 177.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.42 -43.19 93.1 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.181 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 31.7 m -67.91 -36.56 80.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.617 178.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.508 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -61.7 -40.62 95.65 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.749 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 80.3 t -64.89 -43.21 96.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.807 0.337 . . . . 0.0 110.334 177.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.453 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 5.4 tmtm? -55.87 -45.46 78.51 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.166 174.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.556 ' O ' HG21 ' A' ' 41' ' ' VAL . 78.5 t80 -60.96 -56.92 15.42 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.342 178.385 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.508 HD13 ' O ' ' A' ' 32' ' ' ALA . 0.6 OUTLIER -51.59 -42.02 61.62 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.342 -176.207 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -92.06 39.62 1.02 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.328 0.585 . . . . 0.0 111.926 -174.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.679 ' HB3' HG23 ' A' ' 41' ' ' VAL . 27.8 t-20 -88.21 6.45 36.67 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 167.165 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.442 ' HB3' ' O ' ' A' ' 38' ' ' ASN . 46.8 t 76.44 -60.74 0.47 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.792 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 77.6 mtt180 -69.15 -16.34 63.62 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -177.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.679 HG23 ' HB3' ' A' ' 38' ' ' ASN . 97.4 t -69.56 -32.41 52.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.854 0.359 . . . . 0.0 111.138 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 66.1 mtp180 -74.57 -33.19 62.63 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.126 177.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -76.75 -32.45 57.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.993 177.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -58.91 132.67 86.86 Favored Pre-proline 0 N--CA 1.45 -0.435 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.454 173.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -43.89 124.69 4.78 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.542 2.828 . . . . 0.0 113.04 -174.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.865 HD22 ' HB3' ' A' ' 75' ' ' ASP . 5.9 mp -69.54 -18.85 63.7 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.298 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -52.06 -42.71 63.36 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 168.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.491 HG21 ' CE2' ' B' ' 106' ' ' PHE . 68.5 m -67.91 -41.26 82.94 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.263 173.078 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.708 ' CG ' ' HA ' ' A' ' 46' ' ' LEU . 13.4 mmp_? -53.07 -45.83 68.32 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.49 -176.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.579 ' O ' ' HE3' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -62.3 -57.62 10.69 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.834 -0.346 . . . . 0.0 111.644 -179.153 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.37 -42.63 96.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.125 0.488 . . . . 0.0 110.888 -178.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -59.48 -50.5 73.68 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.267 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.521 HD23 ' O ' ' A' ' 49' ' ' ARG . 1.8 mm? -60.29 -47.15 87.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.96 0.41 . . . . 0.0 110.622 179.232 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.811 ' HE2' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -64.87 -35.29 80.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.509 -178.434 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.404 ' HD3' ' HA ' ' A' ' 55' ' ' LYS . 31.8 mmtm -78.3 -23.28 47.21 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.879 ' HE2' ' HA ' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -75.74 -11.07 59.92 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.605 0.241 . . . . 0.0 111.039 -177.843 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.482 ' HA2' ' O ' ' A' ' 21' ' ' ASN . . . 114.06 25.92 3.99 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.123 -1.036 . . . . 0.0 114.108 170.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.601 ' CD1' HG22 ' A' ' 63' ' ' ILE . 2.3 pp -135.87 139.39 43.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 117.396 0.598 . . . . 0.0 110.459 177.524 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.38 173.04 11.45 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.775 -176.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.679 ' O ' HG12 ' A' ' 63' ' ' ILE . 14.0 m-20 -52.06 -47.49 65.1 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -173.106 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -61.65 -28.5 69.43 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.369 -178.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.544 ' HG2' ' HB3' ' A' ' 24' ' ' PRO . 4.9 mp0 -74.98 -29.66 60.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.743 -0.208 . . . . 0.0 110.762 176.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.811 HD13 ' HE2' ' A' ' 54' ' ' LYS . 1.7 pt -69.96 -42.48 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 120.246 -0.582 . . . . 0.0 109.47 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.539 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 9.8 m-20 -73.56 -16.13 61.27 Favored 'General case' 0 C--O 1.211 -0.963 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 177.43 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.414 ' O ' ' HB3' ' A' ' 68' ' ' GLN . 32.4 tpp -73.04 -50.29 23.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.888 0.375 . . . . 0.0 110.441 173.648 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.06 -39.47 90.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.308 0.575 . . . . 0.0 109.937 178.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.507 ' HE1' ' HG ' ' A' ' 36' ' ' LEU . 10.3 m-85 -72.91 -27.76 62.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.925 176.363 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.539 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 22.3 tt0 -60.2 -54.65 43.29 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.488 0.661 . . . . 0.0 109.788 174.088 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -65.93 -27.12 67.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.983 -176.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.3 m -84.08 -9.7 58.4 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.017 177.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 68.75 36.85 83.41 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.367 178.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 41.0 p -115.29 86.21 2.41 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.947 0.403 . . . . 0.0 111.337 -176.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -97.79 -9.72 26.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.997 0.427 . . . . 0.0 110.299 175.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.97 127.23 31.26 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.722 176.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.865 ' HB3' HD22 ' A' ' 46' ' ' LEU . 32.8 t0 67.34 93.21 0.08 Allowed 'General case' 0 C--N 1.323 -0.566 0 O-C-N 124.451 1.095 . . . . 0.0 109.376 -172.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.449 -0.494 0 CA-C-N 114.599 -1.182 . . . . 0.0 112.961 -171.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 101' ' ' SER . . . . . 0.479 ' HB2' ' HG3' ' B' ' 104' ' ' LYS . 50.8 m . . . . . 0 N--CA 1.477 0.904 0 CA-C-O 120.646 0.26 . . . . 0.0 111.014 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -68.82 -25.88 64.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.999 0.428 . . . . 0.0 110.082 178.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -52.46 -40.13 61.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.196 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 104' ' ' LYS . . . . . 0.479 ' HG3' ' HB2' ' B' ' 101' ' ' SER . 81.5 mttt -66.98 -33.17 74.98 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.737 -178.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -62.59 -23.2 66.91 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.395 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 106' ' ' PHE . . . . . 0.491 ' CE2' HG21 ' A' ' 48' ' ' THR . 55.6 m-85 -96.22 -51.49 4.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.544 177.631 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -80.78 -46.71 14.97 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -173.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.77 -49.0 74.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.491 -173.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 109' ' ' LEU . . . . . 0.453 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 89.4 mt -68.99 -9.81 54.25 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -175.089 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 110' ' ' PHE . . . . . 0.441 ' CE2' ' HA ' ' A' ' 32' ' ' ALA . 5.5 t80 -104.18 -5.9 21.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.109 0.481 . . . . 0.0 110.548 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -76.63 -26.15 54.61 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.966 0.412 . . . . 0.0 110.587 -175.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 64.9 m . . . . . 0 C--O 1.247 0.968 0 CA-C-O 118.603 -0.713 . . . . 0.0 110.131 176.095 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo . . . . . 0 C--O 1.234 0.31 0 CA-C-O 121.163 0.401 . . . . 0.0 112.269 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.467 ' HB3' ' HG2' ' A' ' 27' ' ' PRO . 92.5 mtt180 -135.88 139.09 43.1 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.778 -175.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.603 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 36.3 tt0 -61.36 -41.2 78.33 Favored Pre-proline 0 CA--C 1.54 0.57 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.275 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.603 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 5.0 Cg_endo -50.88 -30.74 31.21 Favored 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 122.061 1.84 . . . . 0.0 112.412 173.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 99.7 mt -68.5 -44.52 74.52 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 43.7 mm -58.62 -49.1 83.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.2 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.92 -47.37 83.03 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.14 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 32.1 m -64.34 -36.01 82.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.886 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.78 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -69.11 -49.51 56.48 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.401 -178.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 90.9 t -57.44 -42.24 80.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-O 120.751 0.31 . . . . 0.0 110.458 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.549 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.7 tmmm? -58.42 -48.11 81.76 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.995 174.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.629 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 80.1 t80 -56.7 -54.86 41.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.7 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.78 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 32.9 mt -58.05 -54.51 46.17 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.533 -174.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -93.59 20.31 7.53 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.656 -173.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -66.87 -53.9 27.69 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 174.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.2 p -172.48 -69.32 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.174 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -91.07 -21.54 21.18 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -167.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.506 ' HB ' ' HA ' ' A' ' 36' ' ' LEU . 40.1 t -67.29 -33.27 61.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.728 -173.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.546 ' HG2' ' O ' ' A' ' 36' ' ' LEU . 13.1 mmm180 -62.99 -28.49 70.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.019 0.437 . . . . 0.0 110.357 175.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -95.57 -6.32 40.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.976 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.2 t -80.11 136.78 53.48 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.012 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_exo -57.92 143.3 96.21 Favored 'Trans proline' 0 C--O 1.237 0.428 0 C-N-CA 122.963 2.442 . . . . 0.0 111.96 178.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.551 HD21 HH21 ' A' ' 49' ' ' ARG . 0.9 OUTLIER -68.72 -19.51 64.36 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.206 -176.953 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -53.29 -42.29 66.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.743 0.306 . . . . 0.0 110.337 172.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 84.7 m -71.22 -53.04 15.76 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.48 172.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.551 HH21 HD21 ' A' ' 46' ' ' LEU . 15.6 mtm180 -60.18 -34.2 73.27 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -169.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.469 ' HA ' HD11 ' A' ' 63' ' ' ILE . 6.1 mpp_? -67.67 -56.77 8.06 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 121.263 -0.175 . . . . 0.0 111.332 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.449 ' O ' ' HG3' ' A' ' 55' ' ' LYS . . . -59.7 -43.29 94.15 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 177.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.811 ' HD1' HD12 ' A' ' 53' ' ' LEU . 79.6 t80 -50.66 -66.92 0.3 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.414 -178.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.811 HD12 ' HD1' ' A' ' 52' ' ' PHE . 8.2 mp -60.32 -40.03 89.16 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.729 0.299 . . . . 0.0 111.292 -175.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 58' ' ' LEU . 60.1 mttm -63.24 -37.76 88.49 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.225 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 51' ' ' ALA . 29.6 mtpp -78.64 -27.62 45.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.47 179.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.948 ' HE2' ' HA ' ' A' ' 56' ' ' LYS . 9.3 mmpt? -69.75 -25.29 63.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.205 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 135.65 2.54 2.84 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.157 -1.02 . . . . 0.0 113.02 177.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.541 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 5.8 mp -92.45 126.69 37.64 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.865 0.364 . . . . 0.0 110.459 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.2 p -70.4 173.63 6.66 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 116.244 -0.435 . . . . 0.0 109.952 174.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.613 ' O ' HG22 ' A' ' 63' ' ' ILE . 3.3 m-20 -56.25 -45.07 80.2 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.263 0.554 . . . . 0.0 110.392 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.455 ' O ' ' HG2' ' A' ' 65' ' ' MET . 10.3 pt-20 -56.3 -42.43 77.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.065 177.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -72.29 -33.59 67.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.424 -174.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.728 HG13 HD22 ' A' ' 53' ' ' LEU . 17.4 tt -69.71 -36.27 69.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 120.001 -0.679 . . . . 0.0 110.816 -177.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.66 -28.13 58.62 Favored 'General case' 0 C--O 1.211 -0.969 0 C-N-CA 119.072 -1.051 . . . . 0.0 109.316 173.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.476 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 21.9 mmt -59.45 -51.88 68.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.806 0.336 . . . . 0.0 110.246 175.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.94 -42.29 99.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.074 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.529 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 6.8 m-85 -73.13 -29.05 62.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.941 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -71.48 -40.45 70.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.217 0.532 . . . . 0.0 109.8 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.454 ' HG2' ' O ' ' A' ' 65' ' ' MET . 14.5 mm100 -69.95 -39.99 75.72 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.113 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 27.1 p -78.11 -24.28 47.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.022 0.439 . . . . 0.0 110.857 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 73.43 70.36 1.25 Allowed Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 121.091 -0.576 . . . . 0.0 113.151 174.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.0 p . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 110.218 -0.289 . . . . 0.0 110.218 174.834 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 78.2 tttt . . . . . 0 N--CA 1.457 -0.123 0 CA-C-O 120.804 0.335 . . . . 0.0 110.407 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -62.52 -32.52 73.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.523 178.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 106' ' ' PHE . . . . . 0.629 ' HD2' ' HZ ' ' A' ' 35' ' ' PHE . 62.1 m-85 -76.99 -26.67 54.15 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.435 0.636 . . . . 0.0 110.141 178.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -91.55 -61.44 1.64 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.841 -172.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -60.25 -45.83 91.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.614 -175.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.549 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 34.6 tp -68.22 -30.92 70.09 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.532 -174.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 110' ' ' PHE . . . . . 0.612 ' HE2' ' HA ' ' A' ' 32' ' ' ALA . 8.5 t80 -92.45 -16.57 25.69 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.803 -177.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -59.37 -43.92 92.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.228 0.537 . . . . 0.0 110.051 176.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 37.6 m . . . . . 0 C--O 1.251 1.159 0 CA-C-N 115.219 -0.901 . . . . 0.0 109.538 177.698 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.802 ' HB2' ' HG3' ' A' ' 62' ' ' GLU . 96.5 Cg_endo . . . . . 0 N--CA 1.45 -1.04 0 CA-C-O 121.016 0.34 . . . . 0.0 112.411 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 66.8 mtm180 -134.01 169.8 16.58 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.979 179.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.551 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 8.8 tp10 -53.87 -50.9 81.3 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -176.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.551 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 10.2 Cg_endo -52.48 -28.26 35.25 Favored 'Trans proline' 0 C--N 1.36 1.154 0 C-N-CA 122.745 2.297 . . . . 0.0 113.359 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 57' ' ' GLY . 4.4 mm? -68.59 -44.78 73.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.781 0.324 . . . . 0.0 110.519 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.442 ' O ' HG23 ' A' ' 33' ' ' VAL . 46.2 mm -60.89 -49.89 82.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.479 -179.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.13 -47.69 80.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.502 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 28.1 m -65.99 -37.61 86.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.742 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.8 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -67.24 -48.51 67.58 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.042 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.452 HG13 ' HB3' ' A' ' 70' ' ' SER . 84.3 t -58.76 -42.58 85.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-O 120.552 0.215 . . . . 0.0 110.826 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.504 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.6 tmmm? -55.75 -46.01 77.94 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.274 0.559 . . . . 0.0 109.918 174.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.506 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 73.9 t80 -61.53 -52.61 63.75 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.718 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.954 ' HA ' HG11 ' A' ' 41' ' ' VAL . 54.5 mt -57.92 -37.57 74.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.042 -173.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -96.96 34.5 1.71 Allowed 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 120.836 0.351 . . . . 0.0 111.576 -177.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -94.06 28.69 2.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.157 0.503 . . . . 0.0 110.15 175.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.2 t 69.04 -67.47 0.21 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.704 176.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -64.92 -22.86 67.07 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.28 -175.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.954 HG11 ' HA ' ' A' ' 36' ' ' LEU . 40.9 t -68.73 -33.1 57.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -178.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -80.7 -18.26 48.46 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.044 0.449 . . . . 0.0 110.628 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -86.82 -35.34 19.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.323 0.582 . . . . 0.0 109.459 173.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.492 ' CB ' HH12 ' A' ' 49' ' ' ARG . 43.2 t -65.26 133.45 95.52 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.224 176.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -42.91 128.37 5.19 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 124.206 3.271 . . . . 0.0 114.272 -174.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.533 ' H ' HD12 ' A' ' 46' ' ' LEU . 4.6 mp -64.57 -20.24 66.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.948 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -55.39 -44.17 75.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.435 173.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.1 m -67.14 -40.92 86.8 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.822 174.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.538 ' HB3' ' CZ ' ' A' ' 67' ' ' PHE . 16.9 mmp_? -52.59 -48.84 66.01 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.525 -174.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -58.68 -61.41 2.63 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.642 0.258 . . . . 0.0 111.633 -176.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.08 -42.12 97.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.782 -178.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.707 ' HD1' HD12 ' A' ' 53' ' ' LEU . 58.4 t80 -51.78 -58.22 7.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.258 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.822 HD22 HG13 ' A' ' 63' ' ' ILE . 8.0 mp -60.58 -44.89 95.69 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 121.049 -0.26 . . . . 0.0 111.221 -177.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -67.46 -30.9 70.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.044 0.45 . . . . 0.0 111.544 -175.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.8 mmtm -78.54 -22.92 46.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.537 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.437 ' HD2' ' O ' ' A' ' 52' ' ' PHE . 1.0 OUTLIER -74.46 -41.31 61.0 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.587 175.733 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.525 ' O ' ' HG ' ' A' ' 28' ' ' LEU . . . 148.2 69.66 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.178 -1.011 . . . . 0.0 113.532 175.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.676 HD11 ' HB3' ' A' ' 53' ' ' LEU . 3.5 pp -166.1 150.82 8.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.854 0.359 . . . . 0.0 110.452 174.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.4 p -90.35 178.17 6.2 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.775 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.466 ' HA ' HG22 ' A' ' 63' ' ' ILE . 1.0 OUTLIER -55.23 -40.09 70.46 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -178.567 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -64.48 -35.64 81.59 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.001 0.429 . . . . 0.0 110.867 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.802 ' HG3' ' HB2' ' A' ' 24' ' ' PRO . 15.0 mm-40 -79.72 -29.1 40.56 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -177.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.822 HG13 HD22 ' A' ' 53' ' ' LEU . 11.6 tt -70.26 -37.06 70.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.043 -0.663 . . . . 0.0 111.083 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -77.47 -19.12 56.43 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 119.088 -1.045 . . . . 0.0 110.16 171.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.655 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 0.7 OUTLIER -61.82 -46.15 90.73 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 171.874 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.83 -46.37 45.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.536 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.582 ' CD1' HD13 ' A' ' 36' ' ' LEU . 0.9 OUTLIER -71.06 -41.64 70.47 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -176.814 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -67.73 -42.57 81.66 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.966 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -61.22 -39.73 91.37 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.901 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.452 ' HB3' HG13 ' A' ' 33' ' ' VAL . 25.0 p -74.7 -6.93 51.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.869 0.366 . . . . 0.0 111.225 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 84.44 8.34 83.42 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 121.01 -0.614 . . . . 0.0 111.899 178.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.2 m . . . . . 0 C--N 1.323 -0.585 0 CA-C-O 120.889 0.376 . . . . 0.0 110.731 -177.2 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 62.6 tttp . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 121.16 0.505 . . . . 0.0 110.134 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -59.85 -35.55 75.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.348 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 106' ' ' PHE . . . . . 0.534 ' HB3' ' CE2' ' A' ' 52' ' ' PHE . 20.1 m-85 -77.13 -24.77 51.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.227 179.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -93.94 -59.12 2.05 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.784 -174.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.3 -30.73 71.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.816 -171.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.504 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 87.6 mt -77.17 -29.54 54.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.705 0.288 . . . . 0.0 111.063 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 110' ' ' PHE . . . . . 0.424 ' CD1' ' HG2' ' A' ' 56' ' ' LYS . 1.1 t80 -90.19 -6.31 55.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.226 0.536 . . . . 0.0 110.19 -178.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -62.26 -52.5 63.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.409 177.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.249 1.051 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.502 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo . . . . . 0 N--CA 1.459 -0.511 0 CA-C-O 120.717 0.215 . . . . 0.0 112.258 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -134.03 142.61 47.67 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.231 0.538 . . . . 0.0 112.134 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.511 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 15.4 tp10 -55.16 -52.36 71.9 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 114.765 -1.107 . . . . 0.0 112.556 177.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 10.6 Cg_endo -55.43 -35.17 91.47 Favored 'Trans proline' 0 C--N 1.358 1.071 0 C-N-CA 122.371 2.047 . . . . 0.0 112.768 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 57' ' ' GLY . 0.6 OUTLIER -64.67 -44.18 91.2 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -178.538 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.1 mt -58.62 -42.97 86.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.484 178.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.04 -44.58 97.19 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.308 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.3 m -69.02 -35.24 76.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.859 178.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.565 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -62.35 -45.12 94.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.195 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.7 t -67.5 -36.66 77.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.708 0.29 . . . . 0.0 110.38 178.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.58 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.5 tmtm? -56.8 -52.38 65.29 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.209 0.528 . . . . 0.0 109.594 173.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.524 ' O ' HG21 ' A' ' 41' ' ' VAL . 85.6 t80 -56.11 -51.96 66.02 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.043 177.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.565 HD13 ' O ' ' A' ' 32' ' ' ALA . 2.8 mp -52.08 -58.25 7.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.4 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -92.58 43.21 1.12 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.294 0.569 . . . . 0.0 111.828 -173.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -75.83 -56.62 4.5 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 167.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.8 p 173.16 -64.75 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.402 176.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.425 ' HE ' ' HB2' ' A' ' 40' ' ' ARG . 15.3 ttm180 -80.22 -25.73 39.48 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.728 -170.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.524 HG21 ' O ' ' A' ' 35' ' ' PHE . 74.0 t -58.13 -38.57 68.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -171.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.7 mtm180 -74.88 -11.83 60.22 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.921 0.391 . . . . 0.0 110.851 -177.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -106.69 2.16 25.6 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.111 0.482 . . . . 0.0 110.198 177.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 41.5 m -85.07 144.02 40.69 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.722 177.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -49.94 122.13 8.59 Favored 'Trans proline' 0 C--O 1.237 0.472 0 C-N-CA 122.964 2.443 . . . . 0.0 112.555 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.685 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 37.0 mt -62.55 -20.09 64.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.312 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -49.58 -49.09 47.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.835 0.35 . . . . 0.0 110.674 172.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.502 HG21 ' CZ ' ' B' ' 106' ' ' PHE . 63.6 m -70.42 -42.91 70.97 Favored 'General case' 0 C--O 1.22 -0.485 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 173.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.671 ' HB2' ' HA ' ' A' ' 46' ' ' LEU . 0.8 OUTLIER -53.34 -44.98 68.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.389 -174.212 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.685 ' HG2' ' O ' ' A' ' 46' ' ' LEU . 30.3 mmt180 -64.23 -61.69 2.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.827 0.346 . . . . 0.0 110.313 -177.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.98 -33.37 71.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.808 -177.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.68 ' HD1' HD12 ' A' ' 53' ' ' LEU . 72.4 t80 -54.69 -56.19 21.77 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.707 -0.678 . . . . 0.0 111.605 179.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.68 HD12 ' HD1' ' A' ' 52' ' ' PHE . 9.7 mp -63.66 -39.11 93.51 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.83 -0.348 . . . . 0.0 111.056 -178.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.717 ' HE2' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -66.77 -38.24 86.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.885 0.374 . . . . 0.0 111.646 -179.572 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.568 ' NZ ' ' HA ' ' A' ' 55' ' ' LYS . 0.8 OUTLIER -79.87 -30.02 40.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 179.606 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.66 ' HE2' ' HA ' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -70.75 -28.67 64.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.03 0.443 . . . . 0.0 110.599 -176.416 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.585 ' O ' ' HG ' ' A' ' 28' ' ' LEU . . . 128.86 64.78 0.11 Allowed Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.213 177.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.561 HD13 HD12 ' A' ' 28' ' ' LEU . 15.2 tp -160.6 155.65 24.44 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 -178.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.568 ' O ' HG23 ' A' ' 63' ' ' ILE . 4.5 p -95.4 163.34 13.28 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.787 ' O ' HG12 ' A' ' 63' ' ' ILE . 4.9 m-20 -55.66 -37.99 68.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.679 0.276 . . . . 0.0 111.33 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -52.52 -52.13 56.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.95 0.405 . . . . 0.0 111.514 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.436 ' HB2' ' HG ' ' A' ' 58' ' ' LEU . 8.8 mp0 -72.49 -25.34 61.38 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.423 -176.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.787 HG12 ' O ' ' A' ' 60' ' ' ASP . 8.1 pt -64.12 -38.85 83.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 C-N-CA 119.695 -0.802 . . . . 0.0 110.718 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.11 -30.84 63.93 Favored 'General case' 0 C--O 1.206 -1.204 0 C-N-CA 119.361 -0.936 . . . . 0.0 109.001 173.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.424 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 2.4 tpt -59.01 -45.17 91.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.088 0.471 . . . . 0.0 109.967 177.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.31 -48.96 54.26 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.147 177.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.468 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.3 m-85 -65.73 -32.35 73.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.841 -178.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -67.93 -44.53 76.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.441 0.639 . . . . 0.0 109.548 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -70.95 -28.83 64.77 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.668 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.9 t -73.15 -15.23 61.47 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.571 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.96 -4.65 75.24 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.09 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 18.4 p . . . . . 0 C--N 1.325 -0.458 0 CA-C-O 121.364 0.602 . . . . 0.0 111.197 -177.957 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? . . . . . 0 CA--C 1.531 0.215 0 CA-C-O 120.954 0.407 . . . . 0.0 110.723 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 105' ' ' PHE . . . . . 0.469 ' O ' ' HE1' ' A' ' 35' ' ' PHE . 82.5 t80 -66.4 -27.66 68.02 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.785 -178.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 106' ' ' PHE . . . . . 0.582 ' HB3' ' CE2' ' A' ' 52' ' ' PHE . 65.1 m-85 -88.97 -33.99 17.02 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.95 0.405 . . . . 0.0 111.332 -177.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -89.45 -43.9 10.53 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -173.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -68.98 -44.75 72.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.787 0.327 . . . . 0.0 111.061 -175.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.58 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 8.8 mp -72.65 -4.57 31.84 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.474 -176.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 110' ' ' PHE . . . . . 0.503 ' CE1' ' HG2' ' A' ' 56' ' ' LYS . 4.5 t80 -104.68 -4.09 22.88 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.926 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -61.58 -64.3 0.99 Allowed 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.378 -177.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 3.0 p . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.75 -0.643 . . . . 0.0 110.906 -179.644 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo . . . . . 0 C--O 1.235 0.352 0 CA-C-O 121.068 0.362 . . . . 0.0 112.911 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.589 ' HB2' HD23 ' A' ' 28' ' ' LEU . 61.6 mtp180 -137.19 128.75 28.51 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.495 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.634 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 32.0 mt-10 -56.92 -35.75 39.06 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -176.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.634 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 4.3 Cg_endo -49.64 -29.76 20.25 Favored 'Trans proline' 0 C--N 1.358 1.079 0 C-N-CA 122.197 1.931 . . . . 0.0 112.996 172.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.589 HD23 ' HB2' ' A' ' 25' ' ' ARG . 4.3 mm? -66.08 -30.97 71.57 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.758 0.313 . . . . 0.0 110.764 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.415 ' O ' HG23 ' A' ' 33' ' ' VAL . 44.9 mm -62.39 -42.95 97.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.868 177.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.3 -46.27 84.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.15 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.6 m -61.73 -41.73 98.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.934 0.397 . . . . 0.0 110.483 177.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.548 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -63.59 -45.3 91.01 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.77 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.443 HG13 HE21 ' A' ' 37' ' ' GLN . 72.3 t -63.88 -39.97 87.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.664 0.269 . . . . 0.0 110.764 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.437 ' HE2' ' O ' ' B' ' 109' ' ' LEU . 0.8 OUTLIER -55.83 -50.5 70.37 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.199 0.524 . . . . 0.0 110.219 174.754 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.424 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 84.4 t80 -59.82 -56.25 24.06 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.638 178.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.548 HD13 ' O ' ' A' ' 32' ' ' ALA . 1.8 mp -50.78 -57.74 7.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.985 -1.007 . . . . 0.0 112.565 -177.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.443 HE21 HG13 ' A' ' 33' ' ' VAL . 35.3 mt-30 -95.28 32.64 1.7 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.641 -171.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -70.1 -63.08 1.15 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 173.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.8 p -167.57 -68.17 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.513 -178.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -96.62 -15.25 21.63 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -171.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.465 ' HB ' ' O ' ' A' ' 36' ' ' LEU . 85.6 t -59.78 -43.44 91.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 112.81 0.671 . . . . 0.0 112.81 -171.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.424 ' HD3' ' HG2' ' A' ' 37' ' ' GLN . 60.1 mtm180 -68.07 -19.03 64.83 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.126 -178.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -92.86 -15.92 25.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.253 0.549 . . . . 0.0 110.456 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 31.0 m -72.24 152.41 92.36 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.119 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -43.31 124.99 4.26 Favored 'Trans proline' 0 C--O 1.237 0.44 0 C-N-CA 123.731 2.954 . . . . 0.0 113.012 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.619 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 5.7 mp -69.28 -33.06 72.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.284 -178.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -55.76 -43.93 77.18 Favored 'General case' 0 C--O 1.234 0.24 0 O-C-N 123.444 0.465 . . . . 0.0 110.632 176.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.514 HG21 ' CZ ' ' B' ' 106' ' ' PHE . 99.9 m -55.97 -52.41 64.27 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.146 173.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.685 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 61.6 mtm180 -65.28 -21.49 66.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.487 -175.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.619 ' HG2' ' O ' ' A' ' 46' ' ' LEU . 32.5 mmt180 -66.56 -61.0 2.21 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 175.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.416 ' O ' ' HG2' ' A' ' 55' ' ' LYS . . . -59.87 -42.94 94.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.022 177.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.674 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 80.2 t80 -49.48 -61.08 2.3 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.985 178.002 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.776 ' HG ' HG13 ' A' ' 63' ' ' ILE . 2.8 mm? -53.12 -42.63 66.21 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -177.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.489 ' HD3' ' O ' ' A' ' 50' ' ' ARG . 1.7 mptm? -67.46 -36.82 81.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.858 0.361 . . . . 0.0 111.136 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 51' ' ' ALA . 13.7 mmmm -78.2 -23.51 47.5 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.143 -0.481 . . . . 0.0 112.078 -177.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.674 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 19.7 mmmt -79.64 -29.11 40.9 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.922 -178.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 128.39 37.98 0.39 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.84 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.7 mp -130.12 132.45 46.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.829 0.347 . . . . 0.0 110.35 177.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 20.8 p -79.03 176.94 9.19 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.604 176.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.479 ' HA ' HG22 ' A' ' 63' ' ' ILE . 8.4 m-20 -59.59 -38.53 81.45 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 -174.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.451 ' HG3' ' HG3' ' A' ' 62' ' ' GLU . 8.5 pt-20 -65.42 -33.33 75.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.262 0.553 . . . . 0.0 110.792 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.451 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 45.3 mt-10 -79.87 -37.03 35.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.627 -176.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.776 HG13 ' HG ' ' A' ' 53' ' ' LEU . 4.6 tt -64.08 -42.74 96.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.953 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.686 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 4.2 p30 -77.98 -19.43 54.5 Favored 'General case' 0 C--O 1.205 -1.274 0 C-N-CA 118.684 -1.207 . . . . 0.0 110.649 174.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.634 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 0.5 OUTLIER -61.91 -47.33 85.43 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.674 173.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.94 -41.12 64.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.921 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.685 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.1 m-85 -73.03 -31.64 64.57 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -178.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.686 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 4.2 tp-100 -67.0 -47.81 70.36 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -70.32 -31.27 68.51 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.755 -177.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 12.5 p -73.86 -9.14 58.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.747 0.308 . . . . 0.0 111.269 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 84.46 27.27 36.48 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.917 -0.659 . . . . 0.0 113.404 173.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 69.7 p . . . . . 0 C--N 1.323 -0.548 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 177.842 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 61.0 tttm . . . . . 0 CA--C 1.529 0.158 0 CA-C-O 121.06 0.457 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -73.07 -34.91 66.53 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.443 -179.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 106' ' ' PHE . . . . . 0.514 ' CZ ' HG21 ' A' ' 48' ' ' THR . 24.7 m-85 -80.37 -20.73 43.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.762 -175.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -98.16 -62.73 1.2 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.701 0.286 . . . . 0.0 111.375 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -64.38 -36.02 82.79 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -170.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.437 ' O ' ' HE2' ' A' ' 34' ' ' LYS . 0.5 OUTLIER -79.99 -4.85 54.3 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.872 0.367 . . . . 0.0 110.887 -173.93 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 110' ' ' PHE . . . . . 0.566 ' CE1' ' HB3' ' A' ' 56' ' ' LYS . 12.9 t80 -100.34 -4.66 28.71 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.847 0.356 . . . . 0.0 110.721 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -56.68 -52.15 66.03 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.861 -178.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 7.4 t . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.121 -0.942 . . . . 0.0 109.221 -178.804 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo . . . . . 0 C--O 1.233 0.225 0 CA-C-O 121.373 0.489 . . . . 0.0 111.711 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.451 HH21 HD22 ' A' ' 28' ' ' LEU . 88.4 mtm180 -105.06 133.72 49.37 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.621 -176.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.541 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 38.8 mt-10 -65.34 -45.21 70.11 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.078 -0.965 . . . . 0.0 112.297 -177.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 19.5 Cg_endo -62.69 -22.97 74.46 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 121.923 1.749 . . . . 0.0 112.268 175.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.451 HD22 HH21 ' A' ' 25' ' ' ARG . 38.8 tp -71.71 -33.11 68.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.9 178.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.526 ' O ' HG23 ' A' ' 33' ' ' VAL . 66.1 mt -62.19 -45.43 98.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 174.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.63 -29.37 70.62 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.651 177.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.439 ' HB ' ' O ' ' A' ' 28' ' ' LEU . 55.3 m -66.6 -43.55 84.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.464 174.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.562 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -62.41 -44.57 96.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.578 178.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 29' ' ' ILE . 40.3 t -61.46 -43.66 97.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.321 178.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.429 ' HE2' ' HB3' ' A' ' 34' ' ' LYS . 3.3 tmmm? -53.27 -51.4 62.39 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.333 0.587 . . . . 0.0 110.359 174.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.422 ' CD2' HG11 ' A' ' 41' ' ' VAL . 85.4 t80 -55.76 -52.12 65.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.422 178.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.605 HD21 ' CD1' ' A' ' 67' ' ' PHE . 5.4 mp -58.01 -51.72 68.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.188 -0.915 . . . . 0.0 113.159 -176.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -79.93 34.54 0.29 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -167.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -100.79 29.26 4.64 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 168.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.0 m 72.31 -65.85 0.33 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 114.624 -1.171 . . . . 0.0 112.078 176.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.8 mtp180 -57.0 -44.27 82.58 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -175.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.452 ' CG1' ' HA ' ' A' ' 36' ' ' LEU . 47.3 t -62.0 -39.29 83.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.844 -174.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 36' ' ' LEU . 55.7 mtm180 -70.37 -13.01 61.96 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.932 -178.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.2 mm-40 -115.59 8.74 15.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.36 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 97.5 p -87.39 154.92 54.34 Favored Pre-proline 0 C--N 1.329 -0.294 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -49.18 116.58 2.31 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.869 2.38 . . . . 0.0 113.027 -178.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.506 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 23.2 mt -58.14 -27.9 64.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.343 177.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.82 -42.45 71.91 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.94 0.4 . . . . 0.0 110.812 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 99.7 m -70.41 -49.82 44.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.216 175.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.826 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 61.0 mtm180 -62.23 -26.42 68.36 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.514 -173.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.55 ' NH1' HD11 ' A' ' 63' ' ' ILE . 22.6 mmm180 -61.21 -61.96 2.19 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.932 0.396 . . . . 0.0 110.61 176.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.71 -32.2 73.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.201 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.67 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 91.6 t80 -54.93 -55.81 26.53 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.862 177.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.926 HD12 ' HB ' ' A' ' 63' ' ' ILE . 19.6 mt -59.55 -44.67 93.17 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.077 0.236 . . . . 0.0 111.026 -177.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 1.109 ' HE2' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -58.51 -44.44 89.47 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.94 0.4 . . . . 0.0 111.032 -179.577 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.443 ' HA ' ' HD3' ' A' ' 55' ' ' LYS . 31.4 mmtp -70.35 -21.38 62.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.584 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.909 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -73.29 -21.63 60.55 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 121.07 -0.252 . . . . 0.0 111.109 179.07 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.05 32.67 1.49 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.399 -0.905 . . . . 0.0 114.211 173.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.765 HD11 ' HB3' ' A' ' 53' ' ' LEU . 1.4 pp -139.37 142.53 37.55 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 117.479 0.639 . . . . 0.0 110.711 175.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.433 ' O ' HG23 ' A' ' 63' ' ' ILE . 1.1 p -70.19 161.89 29.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.828 -0.624 . . . . 0.0 112.524 -172.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.592 ' O ' HG12 ' A' ' 63' ' ' ILE . 6.3 t70 -50.04 -49.13 52.11 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.093 0.557 . . . . 0.0 111.57 -174.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.496 ' HG3' ' HG2' ' A' ' 62' ' ' GLU . 9.4 pt-20 -53.01 -38.69 62.55 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.677 178.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.496 ' HG2' ' HG3' ' A' ' 61' ' ' GLU . 4.7 mm-40 -78.41 -26.51 46.44 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.752 -175.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 1.109 HD13 ' HE2' ' A' ' 54' ' ' LYS . 1.7 pt -67.4 -38.66 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.872 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.663 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 0.3 OUTLIER -75.33 -27.99 59.46 Favored 'General case' 0 C--O 1.212 -0.871 0 C-N-CA 119.801 -0.76 . . . . 0.0 109.246 177.539 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.468 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 2.0 tpt -61.26 -48.49 81.17 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 176.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.62 -47.22 73.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.911 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.826 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 1.4 m-85 -64.62 -37.46 87.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.593 -179.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.663 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 0.5 OUTLIER -60.62 -53.92 51.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.749 0.785 . . . . 0.0 109.237 177.427 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -62.35 -35.09 78.05 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 113.982 -1.463 . . . . 0.0 111.805 -175.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 24.2 m -82.15 -5.33 58.38 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -176.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.74 61.48 6.16 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.054 -0.593 . . . . 0.0 111.777 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 39.9 p . . . . . 0 C--N 1.323 -0.555 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -172.454 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 34.6 mttp . . . . . 0 CA--C 1.52 -0.202 0 CA-C-O 121.013 0.435 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -76.54 -22.26 54.6 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 120.739 -0.385 . . . . 0.0 111.053 -178.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 106' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -96.55 -32.1 12.43 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 119.798 -0.761 . . . . 0.0 111.477 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -98.36 -48.77 4.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.88 0.372 . . . . 0.0 111.859 -177.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -80.88 -32.0 35.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.445 -172.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.419 HD13 ' O ' ' B' ' 109' ' ' LEU . 1.9 tm? -58.77 -31.53 68.46 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.133 0.492 . . . . 0.0 109.855 179.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 110' ' ' PHE . . . . . 0.552 ' CD1' ' HD3' ' A' ' 56' ' ' LYS . 53.5 t80 -64.81 -53.91 39.4 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.829 -178.467 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -50.08 -65.77 0.51 Allowed 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.414 0.446 . . . . 0.0 111.707 -173.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 26.8 m . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.852 -0.594 . . . . 0.0 110.511 -178.658 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo . . . . . 0 C--O 1.234 0.285 0 CA-C-O 121.308 0.461 . . . . 0.0 111.824 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.445 ' O ' HG13 ' A' ' 29' ' ' ILE . 99.2 mtt180 -127.35 165.17 20.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.836 -176.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.638 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 44.0 mt-10 -75.94 -42.07 3.51 Favored Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -175.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.638 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 4.9 Cg_endo -48.31 -43.93 30.65 Favored 'Trans proline' 0 C--N 1.358 1.058 0 C-N-CA 122.734 2.289 . . . . 0.0 113.513 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.564 HD12 ' N ' ' A' ' 29' ' ' ILE . 2.3 pp -77.05 -25.96 53.07 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.529 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.564 ' N ' HD12 ' A' ' 28' ' ' LEU . 82.9 mt -65.84 -49.07 79.62 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 N-CA-C 109.389 -0.596 . . . . 0.0 109.389 174.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.44 -40.08 81.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.508 177.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 34.5 m -64.85 -40.78 95.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.612 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.435 ' O ' HD23 ' A' ' 36' ' ' LEU . . . -67.0 -39.36 87.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.242 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 29' ' ' ILE . 90.8 t -62.58 -49.12 85.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.693 -0.231 . . . . 0.0 110.878 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.524 ' HD2' ' N ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -67.71 -32.75 73.6 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.028 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.529 ' CE2' HG11 ' A' ' 41' ' ' VAL . 89.7 t80 -59.15 -53.35 59.3 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.078 177.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.729 HD13 HG12 ' A' ' 41' ' ' VAL . 3.4 mm? -58.79 -49.05 79.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.277 -178.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.424 HE21 ' HA ' ' A' ' 70' ' ' SER . 72.8 mt-30 -92.17 6.89 44.95 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -172.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.413 ' HB2' ' O ' ' A' ' 34' ' ' LYS . 5.0 t30 -60.67 -45.73 93.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.639 0.257 . . . . 0.0 110.778 -177.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.573 ' HB2' ' HZ ' ' B' ' 105' ' ' PHE . 14.7 m -156.5 -67.05 0.11 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.865 0.365 . . . . 0.0 111.294 -176.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.462 ' HA ' ' NE2' ' A' ' 43' ' ' GLN . 5.3 ptp180 -132.46 -8.83 3.28 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -170.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.729 HG12 HD13 ' A' ' 36' ' ' LEU . 58.3 t -57.51 -40.27 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -172.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.762 ' HG3' HG22 ' A' ' 72' ' ' THR . 33.8 ttp180 -66.08 -21.0 66.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.834 0.349 . . . . 0.0 110.326 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.462 ' NE2' ' HA ' ' A' ' 40' ' ' ARG . 0.5 OUTLIER -97.74 -5.46 34.99 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.488 176.332 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.2 m -83.06 156.59 66.87 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.021 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -45.47 126.2 8.28 Favored 'Trans proline' 0 C--O 1.241 0.645 0 C-N-CA 123.8 3.0 . . . . 0.0 113.665 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.632 ' HG ' ' NH2' ' A' ' 49' ' ' ARG . 6.1 mp -66.66 -24.13 66.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.556 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.46 -44.68 85.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.665 176.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.415 HG21 ' CZ ' ' B' ' 106' ' ' PHE . 84.8 m -64.6 -50.34 67.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.318 176.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.73 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 15.6 mtm180 -65.4 -31.36 72.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.215 -172.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.409 ' HA ' HD11 ' A' ' 63' ' ' ILE . 1.1 mtt-85 -66.4 -52.54 45.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.708 0.29 . . . . 0.0 111.045 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.7 -40.18 96.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.052 0.453 . . . . 0.0 109.958 176.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.801 ' HD1' HD12 ' A' ' 53' ' ' LEU . 77.0 t80 -51.73 -68.56 0.16 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.961 -1.018 . . . . 0.0 111.376 177.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.801 HD12 ' HD1' ' A' ' 52' ' ' PHE . 9.8 mp -57.1 -36.22 70.35 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -175.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.45 -36.12 81.99 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.901 178.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -77.26 -23.66 51.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.872 0.368 . . . . 0.0 111.302 176.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.671 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 19.8 mmmt -77.28 -14.5 59.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.522 -178.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 116.0 22.81 4.46 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.58 -0.819 . . . . 0.0 113.179 176.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.504 ' HG ' HD13 ' A' ' 28' ' ' LEU . 5.7 mp -108.13 140.77 40.83 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.933 0.367 . . . . 0.0 110.739 177.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.8 p -84.43 174.02 10.41 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.834 172.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.578 ' HA ' HG22 ' A' ' 63' ' ' ILE . 0.4 OUTLIER -59.97 -40.89 90.61 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 -178.726 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -59.91 -40.34 88.52 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.289 0.566 . . . . 0.0 110.551 177.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -79.37 -28.04 41.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.146 -174.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.698 HG13 HD22 ' A' ' 53' ' ' LEU . 9.9 tt -69.53 -40.01 79.14 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.778 -178.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.624 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 0.4 OUTLIER -67.73 -40.52 84.19 Favored 'General case' 0 C--O 1.207 -1.149 0 C-N-CA 119.034 -1.066 . . . . 0.0 108.254 174.701 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.518 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 1.4 tpt -56.11 -42.77 77.36 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 120.958 0.409 . . . . 0.0 111.134 -177.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.44 -44.64 70.87 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.975 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.73 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.6 m-85 -69.43 -29.32 67.01 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.624 ' HG2' ' O ' ' A' ' 64' ' ' ASP . 69.6 mm-40 -62.88 -52.7 62.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.306 0.574 . . . . 0.0 109.757 178.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -67.92 -28.55 67.59 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.921 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.424 ' HA ' HE21 ' A' ' 37' ' ' GLN . 11.1 t -75.47 -10.01 59.07 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.203 0.525 . . . . 0.0 111.408 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 67.88 43.31 83.67 Favored Glycine 0 N--CA 1.451 -0.357 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.597 176.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.762 HG22 ' HG3' ' A' ' 42' ' ' ARG . 22.0 p . . . . . 0 C--N 1.323 -0.564 0 CA-C-O 120.535 0.207 . . . . 0.0 110.745 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 46.9 mtpt . . . . . 0 C--O 1.227 -0.103 0 N-CA-C 111.536 0.199 . . . . 0.0 111.536 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 105' ' ' PHE . . . . . 0.573 ' HZ ' ' HB2' ' A' ' 39' ' ' SER . 39.0 t80 -68.21 -27.47 66.41 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.801 0.334 . . . . 0.0 110.237 -178.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 106' ' ' PHE . . . . . 0.453 ' CD2' ' HZ ' ' A' ' 35' ' ' PHE . 60.6 m-85 -87.61 -23.73 24.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.162 0.506 . . . . 0.0 110.812 176.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -93.46 -64.78 1.05 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.589 -174.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -64.64 -22.04 66.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.61 -170.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.508 HD13 ' HA ' ' B' ' 105' ' ' PHE . 10.6 mp -82.72 -10.74 58.77 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.896 -0.322 . . . . 0.0 111.523 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 110' ' ' PHE . . . . . 0.54 ' CE1' ' HB3' ' A' ' 56' ' ' LYS . 2.7 t80 -101.39 -11.88 19.04 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 119.497 -0.881 . . . . 0.0 110.841 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -71.85 -71.93 0.25 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 173.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 52.0 m . . . . . 0 C--O 1.247 0.951 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.651 172.86 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.542 ' HA ' ' OE2' ' A' ' 62' ' ' GLU . 14.4 Cg_exo . . . . . 0 C--O 1.236 0.38 0 CA-C-O 120.788 0.245 . . . . 0.0 112.209 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -143.12 123.86 14.17 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.468 -178.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.649 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 0.5 OUTLIER -67.01 -40.7 30.87 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.374 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.649 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 9.4 Cg_endo -53.22 -35.63 74.49 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 122.145 1.897 . . . . 0.0 112.414 175.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.478 HD22 ' HB2' ' A' ' 58' ' ' LEU . 4.3 tt -76.13 -28.87 57.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.896 0.379 . . . . 0.0 110.027 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.507 HG12 HD11 ' A' ' 58' ' ' LEU . 70.7 mt -60.03 -41.84 87.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 172.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.71 -40.06 95.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.548 176.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.1 m -58.97 -41.07 86.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.3 0.571 . . . . 0.0 110.199 175.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.588 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -67.4 -45.12 77.09 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.076 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 29' ' ' ILE . 73.8 t -62.12 -45.26 99.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -177.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.62 -29.06 69.0 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.108 0.48 . . . . 0.0 110.237 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.491 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 79.9 t80 -66.19 -57.94 6.51 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.414 -0.812 . . . . 0.0 108.995 173.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.588 HD13 ' O ' ' A' ' 32' ' ' ALA . 1.2 mp -50.49 -56.86 9.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.541 -1.209 . . . . 0.0 112.127 -178.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.539 ' HG2' ' HD3' ' A' ' 42' ' ' ARG . 45.9 mt-30 -83.8 34.38 0.49 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -173.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -93.0 25.68 3.12 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 166.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.1 t 73.32 -64.15 0.41 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-N 114.767 -1.106 . . . . 0.0 111.724 178.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -65.53 -23.03 66.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.009 -172.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.487 ' HB ' ' O ' ' A' ' 36' ' ' LEU . 51.8 t -80.57 -37.74 17.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.245 -179.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.539 ' HD3' ' HG2' ' A' ' 37' ' ' GLN . 25.8 mtm180 -66.23 -22.7 66.34 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.225 -0.59 . . . . 0.0 109.689 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -99.46 9.92 42.36 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.761 174.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 28.0 t -91.53 142.41 26.84 Favored Pre-proline 0 C--N 1.326 -0.441 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 176.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.417 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 9.6 Cg_endo -49.91 128.39 21.71 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 123.547 2.832 . . . . 0.0 112.695 -178.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.518 ' O ' ' HG3' ' A' ' 50' ' ' ARG . 7.5 mp -60.93 -30.13 70.03 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.753 -178.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -51.23 -46.53 62.3 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 123.638 0.586 . . . . 0.0 110.787 176.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.503 HG21 ' CZ ' ' B' ' 106' ' ' PHE . 98.4 m -70.51 -53.31 16.71 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.358 176.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.501 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 16.7 mtm180 -55.39 -44.89 76.54 Favored 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.646 0.591 . . . . 0.0 112.235 -171.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.579 ' O ' ' HD3' ' A' ' 54' ' ' LYS . 67.1 mtm180 -63.16 -54.86 31.09 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.85 -176.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.493 ' O ' ' HG2' ' A' ' 55' ' ' LYS . . . -60.48 -43.46 96.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.953 0.406 . . . . 0.0 110.357 178.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.669 ' HD1' HD12 ' A' ' 53' ' ' LEU . 72.2 t80 -49.6 -57.6 6.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.727 178.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.669 HD12 ' HD1' ' A' ' 52' ' ' PHE . 8.6 mp -57.67 -43.99 85.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.717 -0.22 . . . . 0.0 111.38 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.847 ' HE3' HD13 ' A' ' 63' ' ' ILE . 2.2 mptm? -61.64 -46.68 88.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.777 0.322 . . . . 0.0 110.983 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 51' ' ' ALA . 14.5 mmmm -72.23 -23.87 61.3 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.9 -173.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.768 ' HE2' ' HA ' ' A' ' 56' ' ' LYS . 10.3 mmpt? -74.59 -19.2 60.41 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.767 0.317 . . . . 0.0 110.413 177.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.25 51.68 0.35 Allowed Glycine 0 N--CA 1.444 -0.776 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.444 177.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.572 HD23 HG22 ' A' ' 63' ' ' ILE . 22.8 tp -142.19 141.32 32.57 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -179.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.549 ' O ' HG23 ' A' ' 63' ' ' ILE . 1.2 m -76.18 157.02 33.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.713 -178.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.764 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 23.0 p-10 -60.75 -45.87 92.65 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -178.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.66 ' HG3' ' HG3' ' A' ' 62' ' ' GLU . 7.3 pt-20 -52.61 -37.52 58.46 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.699 0.762 . . . . 0.0 111.104 177.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.66 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 47.5 mt-10 -78.91 -27.3 43.78 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.915 -174.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.847 HD13 ' HE3' ' A' ' 54' ' ' LYS . 3.7 pt -70.51 -34.6 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.177 177.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.524 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 0.6 OUTLIER -68.44 -31.79 71.36 Favored 'General case' 0 C--O 1.209 -1.066 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 176.304 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 37.9 tpp -66.97 -42.68 84.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.843 0.354 . . . . 0.0 110.324 177.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.91 -47.46 83.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.151 176.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.501 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 6.9 m-85 -66.49 -31.68 72.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.0 177.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.524 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 0.9 OUTLIER -65.06 -49.74 68.89 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.314 0.578 . . . . 0.0 109.601 -179.278 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -67.22 -30.88 70.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.048 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 32.4 m -83.37 7.74 15.75 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.492 -178.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 61.38 36.89 93.19 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 116.12 -0.491 . . . . 0.0 112.357 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.9 p . . . . . 0 C--N 1.323 -0.583 0 CA-C-O 121.036 0.446 . . . . 0.0 111.341 -175.019 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 89.1 tttt . . . . . 0 C--O 1.224 -0.258 0 CA-C-O 120.489 0.185 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -75.85 -17.38 59.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.8 0.333 . . . . 0.0 110.216 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 106' ' ' PHE . . . . . 0.565 ' HB3' ' CE2' ' A' ' 52' ' ' PHE . 56.4 m-85 -95.22 -18.61 20.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.4 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -97.8 -62.86 1.19 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.144 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -57.24 -48.02 79.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.18 0.514 . . . . 0.0 110.691 -175.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.489 HD13 ' O ' ' B' ' 109' ' ' LEU . 0.5 OUTLIER -70.91 -22.67 62.22 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.65 -176.089 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 110' ' ' PHE . . . . . 0.44 ' HE2' ' HA ' ' A' ' 32' ' ' ALA . 51.1 t80 -93.08 -43.33 8.93 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.078 -178.001 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -57.24 -43.47 82.96 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.26 -176.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 C--O 1.245 0.837 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.143 176.011 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.708 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 52.4 Cg_exo . . . . . 0 C--O 1.234 0.31 0 CA-C-O 120.837 0.266 . . . . 0.0 112.599 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -128.42 95.95 4.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.632 -176.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.607 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 34.6 tt0 -56.32 -42.99 99.02 Favored Pre-proline 0 CA--C 1.541 0.616 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.607 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 9.0 Cg_endo -52.63 -30.08 44.02 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 122.033 1.822 . . . . 0.0 112.537 176.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.649 HD22 HD13 ' A' ' 58' ' ' LEU . 7.1 tt -71.17 -22.0 62.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.416 -178.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.673 HD11 ' HB3' ' A' ' 62' ' ' GLU . 47.4 mm -58.74 -46.53 90.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.723 0.297 . . . . 0.0 110.349 176.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.12 -44.59 95.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.103 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 34.7 m -57.44 -38.3 74.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.723 176.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.787 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -68.99 -48.81 62.19 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.389 -179.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 29' ' ' ILE . 89.1 t -59.47 -45.57 93.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 111.422 0.156 . . . . 0.0 111.422 -177.647 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.593 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 0.0 OUTLIER -69.27 -23.74 63.88 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.888 0.375 . . . . 0.0 110.584 179.404 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.525 ' HZ ' ' CD2' ' B' ' 106' ' ' PHE . 86.5 t80 -70.48 -54.66 11.38 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.389 -0.596 . . . . 0.0 109.389 174.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.787 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 33.3 mt -57.01 -55.52 33.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.427 -176.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -95.17 28.11 2.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.137 -175.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' A' ' 34' ' ' LYS . 15.5 t-20 -68.84 -50.6 48.6 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 173.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.4 p -173.49 -68.08 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.414 176.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 55.8 mtp180 -95.41 -20.22 19.27 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -169.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.525 HG23 ' HE2' ' B' ' 105' ' ' PHE . 48.9 t -63.86 -34.97 71.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 CA-C-N 118.022 0.374 . . . . 0.0 111.498 -174.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.413 ' HD2' HG21 ' A' ' 72' ' ' THR . 6.6 mmm180 -58.3 -29.85 66.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.882 0.373 . . . . 0.0 110.769 174.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -99.02 -5.19 30.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.521 -177.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 51.0 m -80.93 146.77 60.15 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.229 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.403 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 54.1 Cg_exo -52.19 134.24 49.82 Favored 'Trans proline' 0 C--O 1.239 0.528 0 C-N-CA 123.023 2.482 . . . . 0.0 112.794 -178.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.464 ' O ' ' HG3' ' A' ' 50' ' ' ARG . 7.8 mp -64.07 -28.02 69.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.35 -175.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.17 -50.87 71.49 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.366 0.416 . . . . 0.0 110.528 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 98.9 m -57.42 -56.12 25.9 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.809 174.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.64 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 30.7 mtm180 -56.13 -43.49 78.24 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -170.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 66.4 mtm180 -69.24 -48.48 61.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.591 0.234 . . . . 0.0 111.441 -174.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.452 ' O ' ' HG3' ' A' ' 55' ' ' LYS . . . -64.83 -38.29 90.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.258 0.551 . . . . 0.0 109.787 177.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.613 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 55.3 t80 -48.96 -67.56 0.26 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.735 -1.12 . . . . 0.0 112.393 179.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 49' ' ' ARG . 0.4 OUTLIER -68.11 -29.98 69.03 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -174.523 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.874 ' HE2' HD13 ' A' ' 63' ' ' ILE . 59.0 mttm -59.14 -42.12 89.92 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.112 0.482 . . . . 0.0 110.224 173.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 51' ' ' ALA . 28.8 mtpp -74.94 -30.64 61.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.395 -178.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.613 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 11.4 mmpt? -64.42 -27.13 68.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.356 0.598 . . . . 0.0 109.966 176.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 127.57 65.92 0.14 Allowed Glycine 0 N--CA 1.443 -0.881 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.182 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.715 ' HG ' ' HB2' ' A' ' 62' ' ' GLU . 11.8 tp -151.23 144.51 24.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.002 0.43 . . . . 0.0 110.511 -178.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.579 ' O ' HG23 ' A' ' 63' ' ' ILE . 2.7 m -87.94 166.51 14.46 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.97 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.58 ' O ' HG12 ' A' ' 63' ' ' ILE . 4.6 m-20 -50.77 -57.7 7.72 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 122.88 0.472 . . . . 0.0 111.779 178.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.442 ' HA ' ' OD2' ' A' ' 64' ' ' ASP . 7.7 pt-20 -58.52 -27.63 64.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.756 -177.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.715 ' HB2' ' HG ' ' A' ' 58' ' ' LEU . 51.8 mt-10 -79.9 -28.17 39.86 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.854 -178.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.874 HD13 ' HE2' ' A' ' 54' ' ' LYS . 3.2 pt -70.11 -34.15 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 C-N-CA 119.952 -0.699 . . . . 0.0 109.758 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.442 ' OD2' ' HA ' ' A' ' 61' ' ' GLU . 3.0 p30 -77.3 -26.02 51.88 Favored 'General case' 0 C--O 1.21 -0.996 0 C-N-CA 119.532 -0.867 . . . . 0.0 110.223 173.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.642 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 0.3 OUTLIER -56.69 -50.94 70.65 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 119.599 -0.84 . . . . 0.0 108.786 173.318 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.42 -57.68 6.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.456 178.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.64 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 3.6 m-85 -66.13 -38.49 88.28 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -173.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -65.68 -45.75 81.68 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -178.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -77.24 -21.26 54.02 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.258 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 32.5 t -79.6 -14.9 58.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.67 0.271 . . . . 0.0 110.37 176.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 80.37 28.37 48.61 Favored Glycine 0 C--N 1.333 0.368 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.78 176.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.619 HG23 ' HD1' ' A' ' 67' ' ' PHE . 10.2 t . . . . . 0 C--N 1.325 -0.487 0 CA-C-O 122.107 0.956 . . . . 0.0 110.467 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 59.8 tttp . . . . . 0 N--CA 1.462 0.13 0 CA-C-O 121.136 0.493 . . . . 0.0 110.155 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 105' ' ' PHE . . . . . 0.525 ' HE2' HG23 ' A' ' 41' ' ' VAL . 33.4 t80 -69.57 -42.3 74.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.66 -177.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 106' ' ' PHE . . . . . 0.525 ' CD2' ' HZ ' ' A' ' 35' ' ' PHE . 37.8 m-85 -75.92 -38.29 57.85 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -178.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.3 -60.16 2.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.238 -172.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -61.09 -49.97 75.17 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -171.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.593 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 72.6 mt -58.5 -33.96 70.4 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.735 0.302 . . . . 0.0 111.429 -176.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 110' ' ' PHE . . . . . 0.679 ' HE2' ' HA ' ' A' ' 32' ' ' ALA . 6.1 t80 -92.02 -5.95 52.01 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.212 -174.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -73.83 -23.68 59.68 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.816 -178.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.987 -0.53 . . . . 0.0 109.762 176.124 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.473 ' HA ' ' O ' ' A' ' 57' ' ' GLY . 21.5 Cg_exo . . . . . 0 N--CA 1.461 -0.413 0 CA-C-O 120.926 0.303 . . . . 0.0 111.878 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.424 ' HB2' ' HB2' ' A' ' 28' ' ' LEU . 74.4 mtt180 -119.71 160.79 21.87 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.685 179.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.612 ' HB2' ' HD3' ' A' ' 27' ' ' PRO . 39.4 mt-10 -66.18 -55.05 22.41 Favored Pre-proline 0 CA--C 1.539 0.527 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -174.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.612 ' HD3' ' HB2' ' A' ' 26' ' ' GLU . 86.1 Cg_endo -78.85 -16.87 12.57 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 122.083 1.855 . . . . 0.0 112.72 -175.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.424 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 3.4 tt -65.72 -30.52 71.2 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.239 -175.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.7 mt -64.68 -37.76 80.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.125 0.488 . . . . 0.0 110.082 175.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.477 ' HA ' HG12 ' A' ' 33' ' ' VAL . . . -70.81 -39.15 73.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.519 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.6 m -61.13 -39.48 90.2 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 121.024 0.44 . . . . 0.0 110.041 174.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.733 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -66.93 -49.13 66.47 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.436 179.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.477 HG12 ' HA ' ' A' ' 30' ' ' ALA . 9.8 p -64.34 -35.22 73.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.615 -178.418 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.535 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.6 tmmm? -59.09 -52.26 66.52 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 172.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.505 ' HZ ' ' CD2' ' B' ' 106' ' ' PHE . 85.9 t80 -50.95 -52.8 38.76 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.571 179.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.733 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 39.3 mt -59.63 -40.38 87.44 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.764 -176.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.407 HE21 ' HA ' ' A' ' 70' ' ' SER . 95.8 mt-30 -85.95 32.01 0.61 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -172.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -101.71 28.99 5.18 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.239 0.542 . . . . 0.0 109.683 170.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.3 m 70.56 -66.95 0.26 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 114.711 -1.132 . . . . 0.0 112.339 175.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -57.54 -36.12 71.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.635 -173.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.678 HG12 ' HD3' ' A' ' 49' ' ' ARG . 51.5 t -63.03 -44.62 99.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.406 -176.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.514 ' HD2' ' CG2' ' A' ' 72' ' ' THR . 32.9 mtm180 -67.35 -18.76 65.28 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.007 0.432 . . . . 0.0 110.337 -177.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -96.73 -0.87 47.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.682 178.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.6 m -88.22 153.18 51.17 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.289 175.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -60.97 142.37 97.32 Favored 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 122.547 2.165 . . . . 0.0 112.579 -177.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.4 mt -63.11 -23.58 67.51 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.701 177.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.6 -47.59 73.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.355 174.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 73.7 m -70.49 -59.57 2.77 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.324 174.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.897 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 41.0 mtm180 -52.94 -47.41 68.07 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -171.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.433 ' HG2' ' HE2' ' A' ' 67' ' ' PHE . 80.5 mtm180 -67.38 -52.74 36.39 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 121.156 -0.218 . . . . 0.0 111.46 -174.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.44 -34.68 78.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.148 0.499 . . . . 0.0 110.389 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.624 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 49.8 t80 -54.88 -66.41 0.41 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.143 -0.935 . . . . 0.0 112.339 179.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 49' ' ' ARG . 0.5 OUTLIER -68.07 -23.73 64.98 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.713 -173.809 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.584 ' HA ' ' O ' ' A' ' 58' ' ' LEU . 97.4 mttt -63.15 -48.62 77.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.985 0.421 . . . . 0.0 110.683 173.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -67.85 -22.39 65.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.698 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.624 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 11.4 mmpt? -69.78 -45.38 68.13 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.99 176.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.473 ' O ' ' HA ' ' A' ' 24' ' ' PRO . . . 150.79 62.73 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.206 -0.997 . . . . 0.0 113.724 176.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.59 HD11 HD13 ' A' ' 53' ' ' LEU . 3.0 pp -171.89 148.36 2.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.938 0.399 . . . . 0.0 110.75 173.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.625 HG22 ' H ' ' A' ' 60' ' ' ASP . 1.5 m -93.75 177.05 6.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.02 -177.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.681 ' O ' HG12 ' A' ' 63' ' ' ILE . 2.7 m-20 -49.81 -46.03 50.58 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -174.365 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 65' ' ' MET . 8.6 pt-20 -52.15 -40.29 61.2 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.163 0.506 . . . . 0.0 111.356 178.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.572 ' CB ' ' HB2' ' A' ' 58' ' ' LEU . 1.5 mp0 -77.45 -27.03 52.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.354 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.681 HG12 ' O ' ' A' ' 60' ' ' ASP . 2.4 pt -69.53 -39.62 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 120.269 -0.573 . . . . 0.0 110.158 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.54 -26.8 63.73 Favored 'General case' 0 C--O 1.211 -0.956 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 176.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.559 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 19.0 mmt -64.84 -49.9 68.76 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.227 175.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.72 -40.86 84.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.169 0.509 . . . . 0.0 110.365 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.897 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.8 m-85 -69.82 -28.56 65.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.194 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.3 tp60 -65.87 -50.06 65.9 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.037 0.446 . . . . 0.0 110.058 176.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -62.62 -36.94 84.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.888 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.407 ' HA ' HE21 ' A' ' 37' ' ' GLN . 32.4 p -83.86 0.23 48.48 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.572 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.91 37.19 94.28 Favored Glycine 0 C--N 1.334 0.433 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.738 177.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.514 ' CG2' ' HD2' ' A' ' 42' ' ' ARG . 35.9 p . . . . . 0 C--N 1.324 -0.523 0 CA-C-O 121.074 0.464 . . . . 0.0 111.837 -176.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . 0.59 ' HA ' ' HG2' ' B' ' 107' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.226 -0.145 0 CA-C-O 120.599 0.237 . . . . 0.0 110.894 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -70.78 -35.11 72.42 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.787 0.327 . . . . 0.0 110.228 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 106' ' ' PHE . . . . . 0.505 ' CD2' ' HZ ' ' A' ' 35' ' ' PHE . 12.3 m-85 -79.02 -33.48 44.8 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.526 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 107' ' ' GLN . . . . . 0.59 ' HG2' ' HA ' ' B' ' 104' ' ' LYS . 11.4 pt20 -91.65 -50.15 5.91 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -175.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 108' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' B' ' 107' ' ' GLN . 20.5 tt0 -78.58 -28.69 45.91 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 111.628 0.233 . . . . 0.0 111.628 -169.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.535 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 42.2 tp -69.66 -19.3 63.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.08 0.467 . . . . 0.0 110.161 178.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 110' ' ' PHE . . . . . 0.503 ' CE2' ' HA ' ' A' ' 32' ' ' ALA . 2.3 t80 -97.16 -5.2 37.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.855 -179.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -63.33 -52.48 61.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.385 0.612 . . . . 0.0 109.926 177.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 C--O 1.248 0.981 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.606 179.226 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.544 ' HB3' ' HG2' ' A' ' 62' ' ' GLU . 28.7 Cg_endo . . . . . 0 CA--C 1.527 0.17 0 CA-C-O 121.399 0.499 . . . . 0.0 111.988 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.569 ' HB2' ' HB2' ' A' ' 28' ' ' LEU . 74.6 mtt180 -90.2 147.52 23.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.927 -177.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.469 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 13.2 tp10 -61.97 -53.09 62.99 Favored Pre-proline 0 CA--C 1.539 0.533 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.131 -179.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 26.8 Cg_endo -64.2 -20.14 66.71 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 121.993 1.796 . . . . 0.0 112.178 178.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.569 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 46.7 tp -67.78 -46.26 72.51 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.838 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 50.7 mm -64.12 -42.05 94.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.168 177.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.42 -43.19 93.1 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.181 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 31.7 m -67.91 -36.56 80.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.617 178.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.508 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -61.7 -40.62 95.65 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.749 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 80.3 t -64.89 -43.21 96.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.807 0.337 . . . . 0.0 110.334 177.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.453 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 5.4 tmtm? -55.87 -45.46 78.51 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.166 174.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.556 ' O ' HG21 ' A' ' 41' ' ' VAL . 78.5 t80 -60.96 -56.92 15.42 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.342 178.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.508 HD13 ' O ' ' A' ' 32' ' ' ALA . 0.6 OUTLIER -51.59 -42.02 61.62 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.342 -176.207 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -92.06 39.62 1.02 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.328 0.585 . . . . 0.0 111.926 -174.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.679 ' HB3' HG23 ' A' ' 41' ' ' VAL . 27.8 t-20 -88.21 6.45 36.67 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 167.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.442 ' HB3' ' O ' ' A' ' 38' ' ' ASN . 46.8 t 76.44 -60.74 0.47 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.792 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 77.6 mtt180 -69.15 -16.34 63.62 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -177.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.679 HG23 ' HB3' ' A' ' 38' ' ' ASN . 97.4 t -69.56 -32.41 52.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.854 0.359 . . . . 0.0 111.138 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 66.1 mtp180 -74.57 -33.19 62.63 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.126 177.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -76.75 -32.45 57.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.993 177.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -58.91 132.67 86.86 Favored Pre-proline 0 N--CA 1.45 -0.435 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.454 173.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -43.89 124.69 4.78 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.542 2.828 . . . . 0.0 113.04 -174.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.708 ' HA ' ' CG ' ' A' ' 49' ' ' ARG . 5.9 mp -69.54 -18.85 63.7 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.298 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -52.06 -42.71 63.36 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 168.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.491 HG21 ' CE2' ' B' ' 106' ' ' PHE . 68.5 m -67.91 -41.26 82.94 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.263 173.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.708 ' CG ' ' HA ' ' A' ' 46' ' ' LEU . 13.4 mmp_? -53.07 -45.83 68.32 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.49 -176.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.579 ' O ' ' HE3' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -62.3 -57.62 10.69 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.834 -0.346 . . . . 0.0 111.644 -179.153 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.37 -42.63 96.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.125 0.488 . . . . 0.0 110.888 -178.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -59.48 -50.5 73.68 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.267 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.521 HD23 ' O ' ' A' ' 49' ' ' ARG . 1.8 mm? -60.29 -47.15 87.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.96 0.41 . . . . 0.0 110.622 179.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.811 ' HE2' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -64.87 -35.29 80.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.509 -178.434 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.404 ' HD3' ' HA ' ' A' ' 55' ' ' LYS . 31.8 mmtm -78.3 -23.28 47.21 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.879 ' HE2' ' HA ' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -75.74 -11.07 59.92 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.605 0.241 . . . . 0.0 111.039 -177.843 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 114.06 25.92 3.99 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.123 -1.036 . . . . 0.0 114.108 170.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.601 ' CD1' HG22 ' A' ' 63' ' ' ILE . 2.3 pp -135.87 139.39 43.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 117.396 0.598 . . . . 0.0 110.459 177.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.38 173.04 11.45 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.775 -176.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.679 ' O ' HG12 ' A' ' 63' ' ' ILE . 14.0 m-20 -52.06 -47.49 65.1 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -173.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -61.65 -28.5 69.43 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.369 -178.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.544 ' HG2' ' HB3' ' A' ' 24' ' ' PRO . 4.9 mp0 -74.98 -29.66 60.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.743 -0.208 . . . . 0.0 110.762 176.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.811 HD13 ' HE2' ' A' ' 54' ' ' LYS . 1.7 pt -69.96 -42.48 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 120.246 -0.582 . . . . 0.0 109.47 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.539 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 9.8 m-20 -73.56 -16.13 61.27 Favored 'General case' 0 C--O 1.211 -0.963 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 177.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.414 ' O ' ' HB3' ' A' ' 68' ' ' GLN . 32.4 tpp -73.04 -50.29 23.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.888 0.375 . . . . 0.0 110.441 173.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.06 -39.47 90.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.308 0.575 . . . . 0.0 109.937 178.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.507 ' HE1' ' HG ' ' A' ' 36' ' ' LEU . 10.3 m-85 -72.91 -27.76 62.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.925 176.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.539 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 22.3 tt0 -60.2 -54.65 43.29 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.488 0.661 . . . . 0.0 109.788 174.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -65.93 -27.12 67.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.983 -176.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.3 m -84.08 -9.7 58.4 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.017 177.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 68.75 36.85 83.41 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.367 178.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 41.0 p . . . . . 0 C--N 1.321 -0.634 0 CA-C-O 120.947 0.403 . . . . 0.0 111.337 -176.402 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 81.5 mttt . . . . . 0 C--O 1.222 -0.343 0 CA-C-O 120.967 0.413 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -62.59 -23.2 66.91 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.395 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 106' ' ' PHE . . . . . 0.491 ' CE2' HG21 ' A' ' 48' ' ' THR . 55.6 m-85 -96.22 -51.49 4.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.544 177.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -80.78 -46.71 14.97 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -173.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.77 -49.0 74.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.491 -173.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 109' ' ' LEU . . . . . 0.453 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 89.4 mt -68.99 -9.81 54.25 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -175.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 110' ' ' PHE . . . . . 0.441 ' CE2' ' HA ' ' A' ' 32' ' ' ALA . 5.5 t80 -104.18 -5.9 21.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.109 0.481 . . . . 0.0 110.548 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -76.63 -26.15 54.61 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.966 0.412 . . . . 0.0 110.587 -175.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 64.9 m . . . . . 0 C--O 1.247 0.968 0 CA-C-O 118.603 -0.713 . . . . 0.0 110.131 176.095 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 21' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.46 0 N-CA-C 110.364 -0.235 . . . . 0.0 110.364 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.445 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 8.3 t30 73.88 -28.79 0.19 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.287 0.635 . . . . 0.0 111.456 178.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.637 ' HA ' ' HA2' ' A' ' 57' ' ' GLY . 15.9 t -78.9 66.28 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.529 0.681 . . . . 0.0 110.657 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 24' ' ' PRO . 4.3 tt -98.5 114.18 65.02 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 174.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 23' ' ' LEU . 18.2 Cg_endo -58.05 109.14 0.45 Allowed 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.996 2.464 . . . . 0.0 112.269 -177.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.467 ' HB3' ' HG2' ' A' ' 27' ' ' PRO . 92.5 mtt180 -135.88 139.09 43.1 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.778 -175.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.603 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 36.3 tt0 -61.36 -41.2 78.33 Favored Pre-proline 0 CA--C 1.54 0.57 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.275 178.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.603 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 5.0 Cg_endo -50.88 -30.74 31.21 Favored 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 122.061 1.84 . . . . 0.0 112.412 173.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 99.7 mt -68.5 -44.52 74.52 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 43.7 mm -58.62 -49.1 83.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.2 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.92 -47.37 83.03 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.14 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 32.1 m -64.34 -36.01 82.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.886 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.78 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -69.11 -49.51 56.48 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.401 -178.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 90.9 t -57.44 -42.24 80.3 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-O 120.751 0.31 . . . . 0.0 110.458 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.549 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.7 tmmm? -58.42 -48.11 81.76 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.995 174.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.629 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 80.1 t80 -56.7 -54.86 41.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.7 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.78 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 32.9 mt -58.05 -54.51 46.17 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.533 -174.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -93.59 20.31 7.53 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.656 -173.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -66.87 -53.9 27.69 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 174.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.2 p -172.48 -69.32 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.174 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -91.07 -21.54 21.18 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -167.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.506 ' HB ' ' HA ' ' A' ' 36' ' ' LEU . 40.1 t -67.29 -33.27 61.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.728 -173.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.546 ' HG2' ' O ' ' A' ' 36' ' ' LEU . 13.1 mmm180 -62.99 -28.49 70.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.019 0.437 . . . . 0.0 110.357 175.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -95.57 -6.32 40.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.976 -178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 40.2 t -80.11 136.78 53.48 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.012 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_exo -57.92 143.3 96.21 Favored 'Trans proline' 0 C--O 1.237 0.428 0 C-N-CA 122.963 2.442 . . . . 0.0 111.96 178.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.767 HD13 ' HB3' ' A' ' 75' ' ' ASP . 0.9 OUTLIER -68.72 -19.51 64.36 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.206 -176.953 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -53.29 -42.29 66.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.743 0.306 . . . . 0.0 110.337 172.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 84.7 m -71.22 -53.04 15.76 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.48 172.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.551 HH21 HD21 ' A' ' 46' ' ' LEU . 15.6 mtm180 -60.18 -34.2 73.27 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -169.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.469 ' HA ' HD11 ' A' ' 63' ' ' ILE . 6.1 mpp_? -67.67 -56.77 8.06 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 121.263 -0.175 . . . . 0.0 111.332 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.449 ' O ' ' HG3' ' A' ' 55' ' ' LYS . . . -59.7 -43.29 94.15 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 177.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.811 ' HD1' HD12 ' A' ' 53' ' ' LEU . 79.6 t80 -50.66 -66.92 0.3 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.414 -178.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.811 HD12 ' HD1' ' A' ' 52' ' ' PHE . 8.2 mp -60.32 -40.03 89.16 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.729 0.299 . . . . 0.0 111.292 -175.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 58' ' ' LEU . 60.1 mttm -63.24 -37.76 88.49 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.225 -179.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 51' ' ' ALA . 29.6 mtpp -78.64 -27.62 45.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.47 179.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.948 ' HE2' ' HA ' ' A' ' 56' ' ' LYS . 9.3 mmpt? -69.75 -25.29 63.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.205 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.637 ' HA2' ' HA ' ' A' ' 22' ' ' VAL . . . 135.65 2.54 2.84 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.157 -1.02 . . . . 0.0 113.02 177.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.541 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 5.8 mp -92.45 126.69 37.64 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.865 0.364 . . . . 0.0 110.459 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.584 HG23 HG12 ' A' ' 22' ' ' VAL . 2.2 p -70.4 173.63 6.66 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 116.244 -0.435 . . . . 0.0 109.952 174.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.613 ' O ' HG22 ' A' ' 63' ' ' ILE . 3.3 m-20 -56.25 -45.07 80.2 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.263 0.554 . . . . 0.0 110.392 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.455 ' O ' ' HG2' ' A' ' 65' ' ' MET . 10.3 pt-20 -56.3 -42.43 77.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.065 177.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -72.29 -33.59 67.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.424 -174.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.728 HG13 HD22 ' A' ' 53' ' ' LEU . 17.4 tt -69.71 -36.27 69.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 120.001 -0.679 . . . . 0.0 110.816 -177.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.66 -28.13 58.62 Favored 'General case' 0 C--O 1.211 -0.969 0 C-N-CA 119.072 -1.051 . . . . 0.0 109.316 173.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.476 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 21.9 mmt -59.45 -51.88 68.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.806 0.336 . . . . 0.0 110.246 175.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.94 -42.29 99.76 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.074 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.529 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 6.8 m-85 -73.13 -29.05 62.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.941 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -71.48 -40.45 70.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.217 0.532 . . . . 0.0 109.8 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.454 ' HG2' ' O ' ' A' ' 65' ' ' MET . 14.5 mm100 -69.95 -39.99 75.72 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.113 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 27.1 p -78.11 -24.28 47.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.022 0.439 . . . . 0.0 110.857 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 73.43 70.36 1.25 Allowed Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 121.091 -0.576 . . . . 0.0 113.151 174.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.0 p -88.11 -55.68 3.65 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.218 -0.289 . . . . 0.0 110.218 174.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 50.96 69.04 0.69 Allowed 'General case' 0 C--O 1.234 0.254 0 O-C-N 123.867 0.729 . . . . 0.0 112.088 175.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -144.72 -86.57 0.12 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.305 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.767 ' HB3' HD13 ' A' ' 46' ' ' LEU . 11.3 t70 -118.4 87.2 2.68 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 174.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.68 -166.182 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 6.1 p . . . . . 0 N--CA 1.473 0.724 0 CA-C-O 121.166 0.508 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 -72.86 -31.68 64.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.523 -178.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -60.06 -46.1 90.68 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.423 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -67.62 -27.33 66.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.407 178.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -62.52 -32.52 73.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.523 178.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' PHE . . . . . 0.629 ' HD2' ' HZ ' ' A' ' 35' ' ' PHE . 62.1 m-85 -76.99 -26.67 54.15 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.435 0.636 . . . . 0.0 110.141 178.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -91.55 -61.44 1.64 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.841 -172.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -60.25 -45.83 91.91 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.614 -175.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.549 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 34.6 tp -68.22 -30.92 70.09 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.532 -174.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' PHE . . . . . 0.612 ' HE2' ' HA ' ' A' ' 32' ' ' ALA . 8.5 t80 -92.45 -16.57 25.69 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.803 -177.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -59.37 -43.92 92.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.228 0.537 . . . . 0.0 110.051 176.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 37.6 m . . . . . 0 C--O 1.251 1.159 0 CA-C-N 115.219 -0.901 . . . . 0.0 109.538 177.698 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 . . . . . 0 N--CA 1.461 0.089 0 CA-C-O 120.749 0.309 . . . . 0.0 111.491 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -92.17 26.8 2.39 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.19 0.519 . . . . 0.0 110.572 -176.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.8 p -104.57 13.93 7.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.95 -179.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 66.1 tp -56.2 105.4 0.52 Allowed Pre-proline 0 N--CA 1.463 0.206 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.417 -176.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.802 ' HB2' ' HG3' ' A' ' 62' ' ' GLU . 96.5 Cg_endo -92.09 112.95 0.31 Allowed 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 123.178 2.585 . . . . 0.0 112.411 -176.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 66.8 mtm180 -134.01 169.8 16.58 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.979 179.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.551 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 8.8 tp10 -53.87 -50.9 81.3 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -176.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.551 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 10.2 Cg_endo -52.48 -28.26 35.25 Favored 'Trans proline' 0 C--N 1.36 1.154 0 C-N-CA 122.745 2.297 . . . . 0.0 113.359 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 57' ' ' GLY . 4.4 mm? -68.59 -44.78 73.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.781 0.324 . . . . 0.0 110.519 179.244 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.442 ' O ' HG23 ' A' ' 33' ' ' VAL . 46.2 mm -60.89 -49.89 82.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.479 -179.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.13 -47.69 80.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.502 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 28.1 m -65.99 -37.61 86.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.742 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.8 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -67.24 -48.51 67.58 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.042 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.452 HG13 ' HB3' ' A' ' 70' ' ' SER . 84.3 t -58.76 -42.58 85.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-O 120.552 0.215 . . . . 0.0 110.826 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.504 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.6 tmmm? -55.75 -46.01 77.94 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.274 0.559 . . . . 0.0 109.918 174.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.506 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 73.9 t80 -61.53 -52.61 63.75 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.718 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.954 ' HA ' HG11 ' A' ' 41' ' ' VAL . 54.5 mt -57.92 -37.57 74.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.042 -173.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -96.96 34.5 1.71 Allowed 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 120.836 0.351 . . . . 0.0 111.576 -177.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -94.06 28.69 2.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.157 0.503 . . . . 0.0 110.15 175.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 10.2 t 69.04 -67.47 0.21 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.704 176.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -64.92 -22.86 67.07 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.28 -175.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.954 HG11 ' HA ' ' A' ' 36' ' ' LEU . 40.9 t -68.73 -33.1 57.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -178.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -80.7 -18.26 48.46 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.044 0.449 . . . . 0.0 110.628 179.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -86.82 -35.34 19.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.323 0.582 . . . . 0.0 109.459 173.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.492 ' CB ' HH12 ' A' ' 49' ' ' ARG . 43.2 t -65.26 133.45 95.52 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.224 176.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -42.91 128.37 5.19 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 124.206 3.271 . . . . 0.0 114.272 -174.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.533 ' H ' HD12 ' A' ' 46' ' ' LEU . 4.6 mp -64.57 -20.24 66.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.948 178.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -55.39 -44.17 75.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.435 173.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.1 m -67.14 -40.92 86.8 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.822 174.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.538 ' HB3' ' CZ ' ' A' ' 67' ' ' PHE . 16.9 mmp_? -52.59 -48.84 66.01 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.525 -174.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -58.68 -61.41 2.63 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.642 0.258 . . . . 0.0 111.633 -176.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.08 -42.12 97.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.782 -178.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.707 ' HD1' HD12 ' A' ' 53' ' ' LEU . 58.4 t80 -51.78 -58.22 7.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.258 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.822 HD22 HG13 ' A' ' 63' ' ' ILE . 8.0 mp -60.58 -44.89 95.69 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 121.049 -0.26 . . . . 0.0 111.221 -177.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -67.46 -30.9 70.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.044 0.45 . . . . 0.0 111.544 -175.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.8 mmtm -78.54 -22.92 46.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.537 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.437 ' HD2' ' O ' ' A' ' 52' ' ' PHE . 1.0 OUTLIER -74.46 -41.31 61.0 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.587 175.733 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.525 ' O ' ' HG ' ' A' ' 28' ' ' LEU . . . 148.2 69.66 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.178 -1.011 . . . . 0.0 113.532 175.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.676 HD11 ' HB3' ' A' ' 53' ' ' LEU . 3.5 pp -166.1 150.82 8.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.854 0.359 . . . . 0.0 110.452 174.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.4 p -90.35 178.17 6.2 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.775 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.466 ' HA ' HG22 ' A' ' 63' ' ' ILE . 1.0 OUTLIER -55.23 -40.09 70.46 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -178.567 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -64.48 -35.64 81.59 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.001 0.429 . . . . 0.0 110.867 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.802 ' HG3' ' HB2' ' A' ' 24' ' ' PRO . 15.0 mm-40 -79.72 -29.1 40.56 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -177.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.822 HG13 HD22 ' A' ' 53' ' ' LEU . 11.6 tt -70.26 -37.06 70.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.043 -0.663 . . . . 0.0 111.083 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -77.47 -19.12 56.43 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 119.088 -1.045 . . . . 0.0 110.16 171.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.655 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 0.7 OUTLIER -61.82 -46.15 90.73 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 171.874 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.83 -46.37 45.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.536 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.582 ' CD1' HD13 ' A' ' 36' ' ' LEU . 0.9 OUTLIER -71.06 -41.64 70.47 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -176.814 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -67.73 -42.57 81.66 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.966 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -61.22 -39.73 91.37 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.901 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.452 ' HB3' HG13 ' A' ' 33' ' ' VAL . 25.0 p -74.7 -6.93 51.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.869 0.366 . . . . 0.0 111.225 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 84.44 8.34 83.42 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 121.01 -0.614 . . . . 0.0 111.899 178.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 3.2 m -85.64 96.34 9.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.889 0.376 . . . . 0.0 110.731 -177.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.99 81.62 2.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.204 0.526 . . . . 0.0 110.035 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.468 ' HB1' HD23 ' A' ' 46' ' ' LEU . . . -93.63 44.44 1.13 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.227 -177.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.9 t70 57.97 -141.07 0.75 Allowed 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 -174.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 . . . . . 0 C--N 1.323 -0.563 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 168.601 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 19.1 p . . . . . 0 N--CA 1.475 0.809 0 CA-C-O 120.561 0.219 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -75.44 -25.85 57.81 Favored 'General case' 0 C--N 1.334 -0.084 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -175.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.29 -35.36 79.31 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.115 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -71.9 -35.11 69.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.16 0.505 . . . . 0.0 110.134 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -59.85 -35.55 75.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.348 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' PHE . . . . . 0.534 ' HB3' ' CE2' ' A' ' 52' ' ' PHE . 20.1 m-85 -77.13 -24.77 51.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.227 179.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -93.94 -59.12 2.05 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.784 -174.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.3 -30.73 71.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.816 -171.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.504 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 87.6 mt -77.17 -29.54 54.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.705 0.288 . . . . 0.0 111.063 -179.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' PHE . . . . . 0.424 ' CD1' ' HG2' ' A' ' 56' ' ' LYS . 1.1 t80 -90.19 -6.31 55.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.226 0.536 . . . . 0.0 110.19 -178.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -62.26 -52.5 63.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.409 177.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.249 1.051 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.502 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.676 ' HB2' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.43 0 CA-C-O 121.21 0.529 . . . . 0.0 111.009 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.475 ' O ' ' HA2' ' A' ' 57' ' ' GLY . 95.4 m-20 67.96 29.42 6.5 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.281 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.922 HG12 HG22 ' A' ' 59' ' ' THR . 16.5 t -92.8 66.66 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 177.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.554 ' O ' ' HA ' ' A' ' 58' ' ' LEU . 54.4 tp -98.63 108.03 46.02 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.033 -0.985 . . . . 0.0 112.004 -171.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -86.79 94.38 0.51 Allowed 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.535 2.157 . . . . 0.0 112.258 176.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.44 ' HD3' HD21 ' A' ' 23' ' ' LEU . 79.4 mtp180 -134.03 142.61 47.67 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.231 0.538 . . . . 0.0 112.134 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.511 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 15.4 tp10 -55.16 -52.36 71.9 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 114.765 -1.107 . . . . 0.0 112.556 177.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 10.6 Cg_endo -55.43 -35.17 91.47 Favored 'Trans proline' 0 C--N 1.358 1.071 0 C-N-CA 122.371 2.047 . . . . 0.0 112.768 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 57' ' ' GLY . 0.6 OUTLIER -64.67 -44.18 91.2 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -178.538 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.1 mt -58.62 -42.97 86.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.484 178.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.04 -44.58 97.19 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.308 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.3 m -69.02 -35.24 76.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.859 178.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.565 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -62.35 -45.12 94.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.195 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.7 t -67.5 -36.66 77.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.708 0.29 . . . . 0.0 110.38 178.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.58 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.5 tmtm? -56.8 -52.38 65.29 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.209 0.528 . . . . 0.0 109.594 173.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.524 ' O ' HG21 ' A' ' 41' ' ' VAL . 85.6 t80 -56.11 -51.96 66.02 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.043 177.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.565 HD13 ' O ' ' A' ' 32' ' ' ALA . 2.8 mp -52.08 -58.25 7.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.4 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -92.58 43.21 1.12 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.294 0.569 . . . . 0.0 111.828 -173.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -75.83 -56.62 4.5 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 167.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.8 p 173.16 -64.75 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.402 176.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.425 ' HE ' ' HB2' ' A' ' 40' ' ' ARG . 15.3 ttm180 -80.22 -25.73 39.48 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.728 -170.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.524 HG21 ' O ' ' A' ' 35' ' ' PHE . 74.0 t -58.13 -38.57 68.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -171.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.7 mtm180 -74.88 -11.83 60.22 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.921 0.391 . . . . 0.0 110.851 -177.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.2 mm-40 -106.69 2.16 25.6 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.111 0.482 . . . . 0.0 110.198 177.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 41.5 m -85.07 144.02 40.69 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.722 177.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -49.94 122.13 8.59 Favored 'Trans proline' 0 C--O 1.237 0.472 0 C-N-CA 122.964 2.443 . . . . 0.0 112.555 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.685 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 37.0 mt -62.55 -20.09 64.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.312 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -49.58 -49.09 47.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.835 0.35 . . . . 0.0 110.674 172.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.502 HG21 ' CZ ' ' B' ' 106' ' ' PHE . 63.6 m -70.42 -42.91 70.97 Favored 'General case' 0 C--O 1.22 -0.485 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 173.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.671 ' HB2' ' HA ' ' A' ' 46' ' ' LEU . 0.8 OUTLIER -53.34 -44.98 68.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.389 -174.212 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.685 ' HG2' ' O ' ' A' ' 46' ' ' LEU . 30.3 mmt180 -64.23 -61.69 2.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.827 0.346 . . . . 0.0 110.313 -177.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.98 -33.37 71.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.808 -177.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.68 ' HD1' HD12 ' A' ' 53' ' ' LEU . 72.4 t80 -54.69 -56.19 21.77 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.707 -0.678 . . . . 0.0 111.605 179.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.68 HD12 ' HD1' ' A' ' 52' ' ' PHE . 9.7 mp -63.66 -39.11 93.51 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.83 -0.348 . . . . 0.0 111.056 -178.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.717 ' HE2' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -66.77 -38.24 86.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.885 0.374 . . . . 0.0 111.646 -179.572 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.568 ' NZ ' ' HA ' ' A' ' 55' ' ' LYS . 0.8 OUTLIER -79.87 -30.02 40.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 179.606 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.66 ' HE2' ' HA ' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -70.75 -28.67 64.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.03 0.443 . . . . 0.0 110.599 -176.416 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.585 ' O ' ' HG ' ' A' ' 28' ' ' LEU . . . 128.86 64.78 0.11 Allowed Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.213 177.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.561 HD13 HD12 ' A' ' 28' ' ' LEU . 15.2 tp -160.6 155.65 24.44 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 -178.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.922 HG22 HG12 ' A' ' 22' ' ' VAL . 4.5 p -95.4 163.34 13.28 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.787 ' O ' HG12 ' A' ' 63' ' ' ILE . 4.9 m-20 -55.66 -37.99 68.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.679 0.276 . . . . 0.0 111.33 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -52.52 -52.13 56.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.95 0.405 . . . . 0.0 111.514 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.436 ' HB2' ' HG ' ' A' ' 58' ' ' LEU . 8.8 mp0 -72.49 -25.34 61.38 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.423 -176.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.787 HG12 ' O ' ' A' ' 60' ' ' ASP . 8.1 pt -64.12 -38.85 83.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 C-N-CA 119.695 -0.802 . . . . 0.0 110.718 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.11 -30.84 63.93 Favored 'General case' 0 C--O 1.206 -1.204 0 C-N-CA 119.361 -0.936 . . . . 0.0 109.001 173.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.424 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 2.4 tpt -59.01 -45.17 91.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.088 0.471 . . . . 0.0 109.967 177.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.31 -48.96 54.26 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.147 177.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.468 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.3 m-85 -65.73 -32.35 73.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.841 -178.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -67.93 -44.53 76.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.441 0.639 . . . . 0.0 109.548 179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -70.95 -28.83 64.77 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.668 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.9 t -73.15 -15.23 61.47 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.571 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.96 -4.65 75.24 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.09 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 18.4 p -79.97 68.49 6.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.364 0.602 . . . . 0.0 111.197 -177.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -87.36 52.17 2.43 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.492 179.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -132.51 125.69 31.18 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.07 -178.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.9 t70 71.72 133.16 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 O-C-N 124.098 0.874 . . . . 0.0 110.345 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.877 -175.482 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 120.613 0.244 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -72.33 -14.63 61.79 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -173.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . 0.422 ' H ' ' CD ' ' B' ' 103' ' ' GLU . 2.2 mp0 -53.97 -32.24 53.31 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 111.803 0.298 . . . . 0.0 111.803 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -65.21 -38.78 91.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.954 0.407 . . . . 0.0 110.723 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' PHE . . . . . 0.469 ' O ' ' HE1' ' A' ' 35' ' ' PHE . 82.5 t80 -66.4 -27.66 68.02 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.785 -178.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' PHE . . . . . 0.582 ' HB3' ' CE2' ' A' ' 52' ' ' PHE . 65.1 m-85 -88.97 -33.99 17.02 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.95 0.405 . . . . 0.0 111.332 -177.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -89.45 -43.9 10.53 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -173.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -68.98 -44.75 72.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.787 0.327 . . . . 0.0 111.061 -175.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.58 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 8.8 mp -72.65 -4.57 31.84 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.474 -176.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' PHE . . . . . 0.503 ' CE1' ' HG2' ' A' ' 56' ' ' LYS . 4.5 t80 -104.68 -4.09 22.88 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.926 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -61.58 -64.3 0.99 Allowed 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.378 -177.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 3.0 p . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.75 -0.643 . . . . 0.0 110.906 -179.644 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.127 0 CA-C-O 120.418 0.151 . . . . 0.0 111.385 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 56.32 54.28 7.85 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.164 0.506 . . . . 0.0 110.757 -179.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.84 ' HA ' ' HA2' ' A' ' 57' ' ' GLY . 2.9 p -85.62 12.82 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 176.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.8 tp -56.47 108.8 1.33 Allowed Pre-proline 0 C--O 1.232 0.178 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.906 -175.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -50.49 105.72 0.11 Allowed 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 123.589 2.86 . . . . 0.0 112.911 -179.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.589 ' HB2' HD23 ' A' ' 28' ' ' LEU . 61.6 mtp180 -137.19 128.75 28.51 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.495 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.634 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 32.0 mt-10 -56.92 -35.75 39.06 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -176.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.634 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 4.3 Cg_endo -49.64 -29.76 20.25 Favored 'Trans proline' 0 C--N 1.358 1.079 0 C-N-CA 122.197 1.931 . . . . 0.0 112.996 172.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.589 HD23 ' HB2' ' A' ' 25' ' ' ARG . 4.3 mm? -66.08 -30.97 71.57 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.758 0.313 . . . . 0.0 110.764 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.415 ' O ' HG23 ' A' ' 33' ' ' VAL . 44.9 mm -62.39 -42.95 97.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.868 177.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.3 -46.27 84.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.15 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.6 m -61.73 -41.73 98.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.934 0.397 . . . . 0.0 110.483 177.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.548 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -63.59 -45.3 91.01 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.77 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.443 HG13 HE21 ' A' ' 37' ' ' GLN . 72.3 t -63.88 -39.97 87.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.664 0.269 . . . . 0.0 110.764 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.437 ' HE2' ' O ' ' B' ' 109' ' ' LEU . 0.8 OUTLIER -55.83 -50.5 70.37 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.199 0.524 . . . . 0.0 110.219 174.754 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.424 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 84.4 t80 -59.82 -56.25 24.06 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.638 178.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.548 HD13 ' O ' ' A' ' 32' ' ' ALA . 1.8 mp -50.78 -57.74 7.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.985 -1.007 . . . . 0.0 112.565 -177.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.443 HE21 HG13 ' A' ' 33' ' ' VAL . 35.3 mt-30 -95.28 32.64 1.7 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.641 -171.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -70.1 -63.08 1.15 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 173.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.8 p -167.57 -68.17 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.513 -178.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -96.62 -15.25 21.63 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -171.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.465 ' HB ' ' O ' ' A' ' 36' ' ' LEU . 85.6 t -59.78 -43.44 91.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 112.81 0.671 . . . . 0.0 112.81 -171.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.424 ' HD3' ' HG2' ' A' ' 37' ' ' GLN . 60.1 mtm180 -68.07 -19.03 64.83 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.126 -178.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -92.86 -15.92 25.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.253 0.549 . . . . 0.0 110.456 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 31.0 m -72.24 152.41 92.36 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.119 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -43.31 124.99 4.26 Favored 'Trans proline' 0 C--O 1.237 0.44 0 C-N-CA 123.731 2.954 . . . . 0.0 113.012 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.619 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 5.7 mp -69.28 -33.06 72.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.284 -178.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -55.76 -43.93 77.18 Favored 'General case' 0 C--O 1.234 0.24 0 O-C-N 123.444 0.465 . . . . 0.0 110.632 176.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.514 HG21 ' CZ ' ' B' ' 106' ' ' PHE . 99.9 m -55.97 -52.41 64.27 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.146 173.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.685 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 61.6 mtm180 -65.28 -21.49 66.73 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.487 -175.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.619 ' HG2' ' O ' ' A' ' 46' ' ' LEU . 32.5 mmt180 -66.56 -61.0 2.21 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 175.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.416 ' O ' ' HG2' ' A' ' 55' ' ' LYS . . . -59.87 -42.94 94.82 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.022 177.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.674 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 80.2 t80 -49.48 -61.08 2.3 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.985 178.002 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.776 ' HG ' HG13 ' A' ' 63' ' ' ILE . 2.8 mm? -53.12 -42.63 66.21 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -177.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.489 ' HD3' ' O ' ' A' ' 50' ' ' ARG . 1.7 mptm? -67.46 -36.82 81.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.858 0.361 . . . . 0.0 111.136 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 51' ' ' ALA . 13.7 mmmm -78.2 -23.51 47.5 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.143 -0.481 . . . . 0.0 112.078 -177.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.674 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 19.7 mmmt -79.64 -29.11 40.9 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.922 -178.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.84 ' HA2' ' HA ' ' A' ' 22' ' ' VAL . . . 128.39 37.98 0.39 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.84 178.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.7 mp -130.12 132.45 46.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.829 0.347 . . . . 0.0 110.35 177.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 20.8 p -79.03 176.94 9.19 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.604 176.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.479 ' HA ' HG22 ' A' ' 63' ' ' ILE . 8.4 m-20 -59.59 -38.53 81.45 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 -174.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.451 ' HG3' ' HG3' ' A' ' 62' ' ' GLU . 8.5 pt-20 -65.42 -33.33 75.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.262 0.553 . . . . 0.0 110.792 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.451 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 45.3 mt-10 -79.87 -37.03 35.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.627 -176.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.776 HG13 ' HG ' ' A' ' 53' ' ' LEU . 4.6 tt -64.08 -42.74 96.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.953 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.686 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 4.2 p30 -77.98 -19.43 54.5 Favored 'General case' 0 C--O 1.205 -1.274 0 C-N-CA 118.684 -1.207 . . . . 0.0 110.649 174.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.634 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 0.5 OUTLIER -61.91 -47.33 85.43 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.674 173.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.94 -41.12 64.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.921 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.685 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.1 m-85 -73.03 -31.64 64.57 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -178.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.686 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 4.2 tp-100 -67.0 -47.81 70.36 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -70.32 -31.27 68.51 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.755 -177.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 12.5 p -73.86 -9.14 58.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.747 0.308 . . . . 0.0 111.269 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 84.46 27.27 36.48 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.917 -0.659 . . . . 0.0 113.404 173.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 69.7 p -78.54 -73.04 0.34 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 177.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 52.8 42.25 31.84 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.124 0.488 . . . . 0.0 112.052 174.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -90.02 -45.49 9.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.395 177.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -160.9 173.65 14.99 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.211 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 . . . . . 0 C--N 1.324 -0.508 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.493 -177.626 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 11.8 p . . . . . 0 N--CA 1.477 0.899 0 CA-C-O 121.276 0.56 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -67.69 -51.5 48.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.851 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -59.68 -44.18 93.73 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.129 0.49 . . . . 0.0 110.642 -176.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -60.85 -31.06 70.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.825 -179.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -73.07 -34.91 66.53 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.443 -179.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' PHE . . . . . 0.514 ' CZ ' HG21 ' A' ' 48' ' ' THR . 24.7 m-85 -80.37 -20.73 43.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.762 -175.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -98.16 -62.73 1.2 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.701 0.286 . . . . 0.0 111.375 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -64.38 -36.02 82.79 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -170.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.437 ' O ' ' HE2' ' A' ' 34' ' ' LYS . 0.5 OUTLIER -79.99 -4.85 54.3 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.872 0.367 . . . . 0.0 110.887 -173.93 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' PHE . . . . . 0.566 ' CE1' ' HB3' ' A' ' 56' ' ' LYS . 12.9 t80 -100.34 -4.66 28.71 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.847 0.356 . . . . 0.0 110.721 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -56.68 -52.15 66.03 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.861 -178.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 7.4 t . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.121 -0.942 . . . . 0.0 109.221 -178.804 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.422 ' OE2' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.267 0 CA-C-O 120.66 0.267 . . . . 0.0 111.526 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 18.0 m120 73.05 0.83 3.82 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.188 -176.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.422 HG23 ' OE2' ' A' ' 20' ' ' GLU . 7.2 t 41.55 78.99 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 114.887 -1.051 . . . . 0.0 112.905 173.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.449 ' HA ' ' HD2' ' A' ' 24' ' ' PRO . 4.3 mm? -97.75 108.2 44.41 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.109 174.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.449 ' HD2' ' HA ' ' A' ' 23' ' ' LEU . 24.4 Cg_endo -61.79 83.14 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.954 2.436 . . . . 0.0 111.711 177.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.451 HH21 HD22 ' A' ' 28' ' ' LEU . 88.4 mtm180 -105.06 133.72 49.37 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.621 -176.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.541 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 38.8 mt-10 -65.34 -45.21 70.11 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.078 -0.965 . . . . 0.0 112.297 -177.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 19.5 Cg_endo -62.69 -22.97 74.46 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 121.923 1.749 . . . . 0.0 112.268 175.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.451 HD22 HH21 ' A' ' 25' ' ' ARG . 38.8 tp -71.71 -33.11 68.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.9 178.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.526 ' O ' HG23 ' A' ' 33' ' ' VAL . 66.1 mt -62.19 -45.43 98.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 174.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.63 -29.37 70.62 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.651 177.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.439 ' HB ' ' O ' ' A' ' 28' ' ' LEU . 55.3 m -66.6 -43.55 84.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.464 174.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.562 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -62.41 -44.57 96.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.578 178.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 29' ' ' ILE . 40.3 t -61.46 -43.66 97.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.321 178.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.429 ' HE2' ' HB3' ' A' ' 34' ' ' LYS . 3.3 tmmm? -53.27 -51.4 62.39 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.333 0.587 . . . . 0.0 110.359 174.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.422 ' CD2' HG11 ' A' ' 41' ' ' VAL . 85.4 t80 -55.76 -52.12 65.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.422 178.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.605 HD21 ' CD1' ' A' ' 67' ' ' PHE . 5.4 mp -58.01 -51.72 68.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.188 -0.915 . . . . 0.0 113.159 -176.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -79.93 34.54 0.29 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -167.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -100.79 29.26 4.64 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 168.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.0 m 72.31 -65.85 0.33 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 114.624 -1.171 . . . . 0.0 112.078 176.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.8 mtp180 -57.0 -44.27 82.58 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -175.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.452 ' CG1' ' HA ' ' A' ' 36' ' ' LEU . 47.3 t -62.0 -39.29 83.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.844 -174.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 36' ' ' LEU . 55.7 mtm180 -70.37 -13.01 61.96 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.932 -178.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.2 mm-40 -115.59 8.74 15.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.36 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 97.5 p -87.39 154.92 54.34 Favored Pre-proline 0 C--N 1.329 -0.294 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_exo -49.18 116.58 2.31 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.869 2.38 . . . . 0.0 113.027 -178.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.506 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 23.2 mt -58.14 -27.9 64.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.343 177.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.82 -42.45 71.91 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.94 0.4 . . . . 0.0 110.812 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 99.7 m -70.41 -49.82 44.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.216 175.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.826 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 61.0 mtm180 -62.23 -26.42 68.36 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.514 -173.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.55 ' NH1' HD11 ' A' ' 63' ' ' ILE . 22.6 mmm180 -61.21 -61.96 2.19 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.932 0.396 . . . . 0.0 110.61 176.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.71 -32.2 73.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.201 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.67 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 91.6 t80 -54.93 -55.81 26.53 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.862 177.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.926 HD12 ' HB ' ' A' ' 63' ' ' ILE . 19.6 mt -59.55 -44.67 93.17 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 123.077 0.236 . . . . 0.0 111.026 -177.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 1.109 ' HE2' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -58.51 -44.44 89.47 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.94 0.4 . . . . 0.0 111.032 -179.577 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.443 ' HA ' ' HD3' ' A' ' 55' ' ' LYS . 31.4 mmtp -70.35 -21.38 62.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.584 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.909 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -73.29 -21.63 60.55 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 121.07 -0.252 . . . . 0.0 111.109 179.07 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.05 32.67 1.49 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.399 -0.905 . . . . 0.0 114.211 173.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.765 HD11 ' HB3' ' A' ' 53' ' ' LEU . 1.4 pp -139.37 142.53 37.55 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 117.479 0.639 . . . . 0.0 110.711 175.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.433 ' O ' HG23 ' A' ' 63' ' ' ILE . 1.1 p -70.19 161.89 29.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.828 -0.624 . . . . 0.0 112.524 -172.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.592 ' O ' HG12 ' A' ' 63' ' ' ILE . 6.3 t70 -50.04 -49.13 52.11 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.093 0.557 . . . . 0.0 111.57 -174.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.496 ' HG3' ' HG2' ' A' ' 62' ' ' GLU . 9.4 pt-20 -53.01 -38.69 62.55 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.677 178.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.496 ' HG2' ' HG3' ' A' ' 61' ' ' GLU . 4.7 mm-40 -78.41 -26.51 46.44 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.752 -175.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 1.109 HD13 ' HE2' ' A' ' 54' ' ' LYS . 1.7 pt -67.4 -38.66 81.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.872 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.663 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 0.3 OUTLIER -75.33 -27.99 59.46 Favored 'General case' 0 C--O 1.212 -0.871 0 C-N-CA 119.801 -0.76 . . . . 0.0 109.246 177.539 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.468 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 2.0 tpt -61.26 -48.49 81.17 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 176.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.62 -47.22 73.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.911 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.826 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 1.4 m-85 -64.62 -37.46 87.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.593 -179.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.663 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 0.5 OUTLIER -60.62 -53.92 51.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.749 0.785 . . . . 0.0 109.237 177.427 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -62.35 -35.09 78.05 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 113.982 -1.463 . . . . 0.0 111.805 -175.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 24.2 m -82.15 -5.33 58.38 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -176.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.74 61.48 6.16 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.054 -0.593 . . . . 0.0 111.777 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 39.9 p -133.02 2.11 3.61 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -172.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -114.54 132.12 56.42 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.778 0.323 . . . . 0.0 110.709 -176.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.53 -37.55 78.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.532 0.682 . . . . 0.0 109.452 174.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -161.45 -46.57 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 173.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 . . . . . 0 C--N 1.326 -0.434 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.038 172.318 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 13.4 p . . . . . 0 N--CA 1.476 0.842 0 N-CA-C 110.634 -0.136 . . . . 0.0 110.634 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -53.98 -41.57 68.01 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -174.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -60.82 -55.4 33.54 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.638 0.236 . . . . 0.0 111.638 -177.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 34.6 mttp -59.65 -33.87 72.09 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.013 0.435 . . . . 0.0 111.232 179.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -76.54 -22.26 54.6 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 120.739 -0.385 . . . . 0.0 111.053 -178.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -96.55 -32.1 12.43 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 119.798 -0.761 . . . . 0.0 111.477 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -98.36 -48.77 4.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.88 0.372 . . . . 0.0 111.859 -177.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -80.88 -32.0 35.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.445 -172.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.419 HD13 ' O ' ' B' ' 109' ' ' LEU . 1.9 tm? -58.77 -31.53 68.46 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.133 0.492 . . . . 0.0 109.855 179.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' PHE . . . . . 0.552 ' CD1' ' HD3' ' A' ' 56' ' ' LYS . 53.5 t80 -64.81 -53.91 39.4 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.829 -178.467 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -50.08 -65.77 0.51 Allowed 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.414 0.446 . . . . 0.0 111.707 -173.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 26.8 m . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.852 -0.594 . . . . 0.0 110.511 -178.658 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 . . . . . 0 CA--C 1.53 0.202 0 CA-C-O 120.853 0.358 . . . . 0.0 111.419 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 23.9 p30 -107.4 -4.05 18.95 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.835 -175.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.575 ' O ' ' HD3' ' A' ' 24' ' ' PRO . 35.5 m -92.12 95.83 5.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.897 0.856 . . . . 0.0 110.493 178.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.451 ' O ' HD21 ' A' ' 28' ' ' LEU . 92.4 mt -99.14 102.54 16.03 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.681 175.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.575 ' HD3' ' O ' ' A' ' 22' ' ' VAL . 31.8 Cg_exo -63.36 86.71 0.13 Allowed 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 123.043 2.495 . . . . 0.0 111.824 176.359 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.445 ' O ' HG13 ' A' ' 29' ' ' ILE . 99.2 mtt180 -127.35 165.17 20.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.836 -176.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.638 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 44.0 mt-10 -75.94 -42.07 3.51 Favored Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -175.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.638 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 4.9 Cg_endo -48.31 -43.93 30.65 Favored 'Trans proline' 0 C--N 1.358 1.058 0 C-N-CA 122.734 2.289 . . . . 0.0 113.513 -179.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.564 HD12 ' N ' ' A' ' 29' ' ' ILE . 2.3 pp -77.05 -25.96 53.07 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.529 -178.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.564 ' N ' HD12 ' A' ' 28' ' ' LEU . 82.9 mt -65.84 -49.07 79.62 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 N-CA-C 109.389 -0.596 . . . . 0.0 109.389 174.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.44 -40.08 81.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.508 177.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 34.5 m -64.85 -40.78 95.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.612 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.435 ' O ' HD23 ' A' ' 36' ' ' LEU . . . -67.0 -39.36 87.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.242 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 29' ' ' ILE . 90.8 t -62.58 -49.12 85.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.693 -0.231 . . . . 0.0 110.878 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.524 ' HD2' ' N ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -67.71 -32.75 73.6 Favored 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.028 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.529 ' CE2' HG11 ' A' ' 41' ' ' VAL . 89.7 t80 -59.15 -53.35 59.3 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.078 177.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.729 HD13 HG12 ' A' ' 41' ' ' VAL . 3.4 mm? -58.79 -49.05 79.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.277 -178.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.424 HE21 ' HA ' ' A' ' 70' ' ' SER . 72.8 mt-30 -92.17 6.89 44.95 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -172.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.413 ' HB2' ' O ' ' A' ' 34' ' ' LYS . 5.0 t30 -60.67 -45.73 93.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.639 0.257 . . . . 0.0 110.778 -177.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.573 ' HB2' ' HZ ' ' B' ' 105' ' ' PHE . 14.7 m -156.5 -67.05 0.11 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.865 0.365 . . . . 0.0 111.294 -176.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.462 ' HA ' ' NE2' ' A' ' 43' ' ' GLN . 5.3 ptp180 -132.46 -8.83 3.28 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -170.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.729 HG12 HD13 ' A' ' 36' ' ' LEU . 58.3 t -57.51 -40.27 73.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -172.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.762 ' HG3' HG22 ' A' ' 72' ' ' THR . 33.8 ttp180 -66.08 -21.0 66.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.834 0.349 . . . . 0.0 110.326 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.462 ' NE2' ' HA ' ' A' ' 40' ' ' ARG . 0.5 OUTLIER -97.74 -5.46 34.99 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.488 176.332 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.2 m -83.06 156.59 66.87 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.021 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -45.47 126.2 8.28 Favored 'Trans proline' 0 C--O 1.241 0.645 0 C-N-CA 123.8 3.0 . . . . 0.0 113.665 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.819 HD22 ' HB3' ' A' ' 75' ' ' ASP . 6.1 mp -66.66 -24.13 66.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.556 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.46 -44.68 85.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.665 176.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.415 HG21 ' CZ ' ' B' ' 106' ' ' PHE . 84.8 m -64.6 -50.34 67.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.318 176.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.73 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 15.6 mtm180 -65.4 -31.36 72.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.215 -172.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.409 ' HA ' HD11 ' A' ' 63' ' ' ILE . 1.1 mtt-85 -66.4 -52.54 45.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.708 0.29 . . . . 0.0 111.045 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.7 -40.18 96.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.052 0.453 . . . . 0.0 109.958 176.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.801 ' HD1' HD12 ' A' ' 53' ' ' LEU . 77.0 t80 -51.73 -68.56 0.16 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.961 -1.018 . . . . 0.0 111.376 177.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.801 HD12 ' HD1' ' A' ' 52' ' ' PHE . 9.8 mp -57.1 -36.22 70.35 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -175.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.45 -36.12 81.99 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.901 178.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -77.26 -23.66 51.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.872 0.368 . . . . 0.0 111.302 176.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.671 ' HA ' ' HE3' ' A' ' 56' ' ' LYS . 19.8 mmmt -77.28 -14.5 59.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.522 -178.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.45 ' HA2' ' HA ' ' A' ' 22' ' ' VAL . . . 116.0 22.81 4.46 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.58 -0.819 . . . . 0.0 113.179 176.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.504 ' HG ' HD13 ' A' ' 28' ' ' LEU . 5.7 mp -108.13 140.77 40.83 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.933 0.367 . . . . 0.0 110.739 177.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 2.8 p -84.43 174.02 10.41 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.834 172.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.578 ' HA ' HG22 ' A' ' 63' ' ' ILE . 0.4 OUTLIER -59.97 -40.89 90.61 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 -178.726 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -59.91 -40.34 88.52 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.289 0.566 . . . . 0.0 110.551 177.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -79.37 -28.04 41.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.146 -174.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.698 HG13 HD22 ' A' ' 53' ' ' LEU . 9.9 tt -69.53 -40.01 79.14 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.778 -178.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.624 ' O ' ' HG2' ' A' ' 68' ' ' GLN . 0.4 OUTLIER -67.73 -40.52 84.19 Favored 'General case' 0 C--O 1.207 -1.149 0 C-N-CA 119.034 -1.066 . . . . 0.0 108.254 174.701 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.518 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 1.4 tpt -56.11 -42.77 77.36 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 120.958 0.409 . . . . 0.0 111.134 -177.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.44 -44.64 70.87 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.975 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.73 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.6 m-85 -69.43 -29.32 67.01 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.624 ' HG2' ' O ' ' A' ' 64' ' ' ASP . 69.6 mm-40 -62.88 -52.7 62.07 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.306 0.574 . . . . 0.0 109.757 178.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -67.92 -28.55 67.59 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.921 -179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.424 ' HA ' HE21 ' A' ' 37' ' ' GLN . 11.1 t -75.47 -10.01 59.07 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.203 0.525 . . . . 0.0 111.408 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 67.88 43.31 83.67 Favored Glycine 0 N--CA 1.451 -0.357 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.597 176.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.762 HG22 ' HG3' ' A' ' 42' ' ' ARG . 22.0 p -77.04 -64.72 1.07 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.535 0.207 . . . . 0.0 110.745 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . 51.41 60.2 4.03 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.65 -0.704 . . . . 0.0 112.586 173.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -127.07 -60.8 1.19 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.839 177.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.819 ' HB3' HD22 ' A' ' 46' ' ' LEU . 32.2 t70 -137.57 145.31 42.7 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 174.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 . . . . . 0 C--N 1.322 -0.592 0 CA-C-O 120.882 0.372 . . . . 0.0 110.668 -174.945 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 30.0 t . . . . . 0 N--CA 1.481 1.11 0 CA-C-O 120.858 0.361 . . . . 0.0 111.289 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 29.9 mm-40 -73.04 -18.46 61.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.428 -172.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -59.84 -32.0 70.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.059 0.457 . . . . 0.0 110.564 175.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 46.9 mtpt -75.37 -9.81 58.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.536 -178.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' PHE . . . . . 0.573 ' HZ ' ' HB2' ' A' ' 39' ' ' SER . 39.0 t80 -68.21 -27.47 66.41 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.801 0.334 . . . . 0.0 110.237 -178.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' PHE . . . . . 0.453 ' CD2' ' HZ ' ' A' ' 35' ' ' PHE . 60.6 m-85 -87.61 -23.73 24.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.162 0.506 . . . . 0.0 110.812 176.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -93.46 -64.78 1.05 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.589 -174.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -64.64 -22.04 66.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.61 -170.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.508 HD13 ' HA ' ' B' ' 105' ' ' PHE . 10.6 mp -82.72 -10.74 58.77 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.896 -0.322 . . . . 0.0 111.523 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' PHE . . . . . 0.54 ' CE1' ' HB3' ' A' ' 56' ' ' LYS . 2.7 t80 -101.39 -11.88 19.04 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 119.497 -0.881 . . . . 0.0 110.841 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -71.85 -71.93 0.25 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 173.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 52.0 m . . . . . 0 C--O 1.247 0.951 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.651 172.86 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 . . . . . 0 C--O 1.233 0.231 0 CA-C-O 120.943 0.401 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.0 t30 177.14 -38.93 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.005 -175.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.844 ' HB ' ' HA ' ' A' ' 59' ' ' THR . 34.7 m -82.94 118.01 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.171 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.583 ' HG ' ' HG2' ' A' ' 25' ' ' ARG . 39.8 tp -99.56 109.02 53.75 Favored Pre-proline 0 C--N 1.318 -0.803 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.663 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.542 ' HA ' ' OE2' ' A' ' 62' ' ' GLU . 14.4 Cg_exo -70.16 91.63 0.55 Allowed 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.822 2.348 . . . . 0.0 112.209 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.583 ' HG2' ' HG ' ' A' ' 23' ' ' LEU . 40.6 mmt180 -143.12 123.86 14.17 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.468 -178.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.649 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 0.5 OUTLIER -67.01 -40.7 30.87 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.374 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.649 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 9.4 Cg_endo -53.22 -35.63 74.49 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 122.145 1.897 . . . . 0.0 112.414 175.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.478 HD22 ' HB2' ' A' ' 58' ' ' LEU . 4.3 tt -76.13 -28.87 57.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.896 0.379 . . . . 0.0 110.027 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.507 HG12 HD11 ' A' ' 58' ' ' LEU . 70.7 mt -60.03 -41.84 87.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 172.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.71 -40.06 95.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.548 176.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.1 m -58.97 -41.07 86.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.3 0.571 . . . . 0.0 110.199 175.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.588 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -67.4 -45.12 77.09 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.076 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 29' ' ' ILE . 73.8 t -62.12 -45.26 99.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -177.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.62 -29.06 69.0 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.108 0.48 . . . . 0.0 110.237 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.491 ' HZ ' ' HD2' ' B' ' 106' ' ' PHE . 79.9 t80 -66.19 -57.94 6.51 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 115.414 -0.812 . . . . 0.0 108.995 173.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.588 HD13 ' O ' ' A' ' 32' ' ' ALA . 1.2 mp -50.49 -56.86 9.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.541 -1.209 . . . . 0.0 112.127 -178.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.539 ' HG2' ' HD3' ' A' ' 42' ' ' ARG . 45.9 mt-30 -83.8 34.38 0.49 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -173.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -93.0 25.68 3.12 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 166.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.1 t 73.32 -64.15 0.41 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-N 114.767 -1.106 . . . . 0.0 111.724 178.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 75.5 mtt180 -65.53 -23.03 66.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.022 -0.535 . . . . 0.0 112.009 -172.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.487 ' HB ' ' O ' ' A' ' 36' ' ' LEU . 51.8 t -80.57 -37.74 17.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.245 -179.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.539 ' HD3' ' HG2' ' A' ' 37' ' ' GLN . 25.8 mtm180 -66.23 -22.7 66.34 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.225 -0.59 . . . . 0.0 109.689 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -99.46 9.92 42.36 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.761 174.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 28.0 t -91.53 142.41 26.84 Favored Pre-proline 0 C--N 1.326 -0.441 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 176.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.417 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 9.6 Cg_endo -49.91 128.39 21.71 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 123.547 2.832 . . . . 0.0 112.695 -178.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.518 ' O ' ' HG3' ' A' ' 50' ' ' ARG . 7.5 mp -60.93 -30.13 70.03 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.753 -178.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -51.23 -46.53 62.3 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 123.638 0.586 . . . . 0.0 110.787 176.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.503 HG21 ' CZ ' ' B' ' 106' ' ' PHE . 98.4 m -70.51 -53.31 16.71 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.358 176.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.501 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 16.7 mtm180 -55.39 -44.89 76.54 Favored 'General case' 0 C--N 1.331 -0.214 0 O-C-N 123.646 0.591 . . . . 0.0 112.235 -171.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.579 ' O ' ' HD3' ' A' ' 54' ' ' LYS . 67.1 mtm180 -63.16 -54.86 31.09 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.85 -176.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.493 ' O ' ' HG2' ' A' ' 55' ' ' LYS . . . -60.48 -43.46 96.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.953 0.406 . . . . 0.0 110.357 178.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.669 ' HD1' HD12 ' A' ' 53' ' ' LEU . 72.2 t80 -49.6 -57.6 6.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.727 178.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.669 HD12 ' HD1' ' A' ' 52' ' ' PHE . 8.6 mp -57.67 -43.99 85.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.717 -0.22 . . . . 0.0 111.38 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.847 ' HE3' HD13 ' A' ' 63' ' ' ILE . 2.2 mptm? -61.64 -46.68 88.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.777 0.322 . . . . 0.0 110.983 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 51' ' ' ALA . 14.5 mmmm -72.23 -23.87 61.3 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.9 -173.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.768 ' HE2' ' HA ' ' A' ' 56' ' ' LYS . 10.3 mmpt? -74.59 -19.2 60.41 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.767 0.317 . . . . 0.0 110.413 177.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 117.25 51.68 0.35 Allowed Glycine 0 N--CA 1.444 -0.776 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.444 177.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.572 HD23 HG22 ' A' ' 63' ' ' ILE . 22.8 tp -142.19 141.32 32.57 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -179.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.844 ' HA ' ' HB ' ' A' ' 22' ' ' VAL . 1.2 m -76.18 157.02 33.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.713 -178.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.764 ' HA ' ' HE2' ' A' ' 54' ' ' LYS . 23.0 p-10 -60.75 -45.87 92.65 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -178.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.66 ' HG3' ' HG3' ' A' ' 62' ' ' GLU . 7.3 pt-20 -52.61 -37.52 58.46 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.699 0.762 . . . . 0.0 111.104 177.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.66 ' HG3' ' HG3' ' A' ' 61' ' ' GLU . 47.5 mt-10 -78.91 -27.3 43.78 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.915 -174.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.847 HD13 ' HE3' ' A' ' 54' ' ' LYS . 3.7 pt -70.51 -34.6 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 C-N-CA 119.98 -0.688 . . . . 0.0 110.177 177.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.524 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 0.6 OUTLIER -68.44 -31.79 71.36 Favored 'General case' 0 C--O 1.209 -1.066 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 176.304 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 37.9 tpp -66.97 -42.68 84.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.843 0.354 . . . . 0.0 110.324 177.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -62.91 -47.46 83.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.151 176.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.501 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 6.9 m-85 -66.49 -31.68 72.57 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.0 177.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.524 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 0.9 OUTLIER -65.06 -49.74 68.89 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.314 0.578 . . . . 0.0 109.601 -179.278 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -67.22 -30.88 70.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.048 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 32.4 m -83.37 7.74 15.75 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.492 -178.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 61.38 36.89 93.19 Favored Glycine 0 C--N 1.336 0.553 0 CA-C-N 116.12 -0.491 . . . . 0.0 112.357 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.9 p -130.84 40.9 3.43 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.036 0.446 . . . . 0.0 111.341 -175.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.2 53.37 2.24 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.511 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -83.57 115.02 21.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.576 178.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.4 t70 64.44 -159.68 0.29 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 -174.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 . . . . . 0 C--N 1.319 -0.748 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.963 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 44.7 m . . . . . 0 N--CA 1.475 0.81 0 CA-C-O 121.013 0.435 . . . . 0.0 110.438 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -96.87 -39.18 9.53 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.974 -177.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . 0.463 ' HA ' ' HD1' ' B' ' 106' ' ' PHE . 42.9 mt-10 -61.76 -29.26 70.01 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -170.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -61.57 -32.89 73.0 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.065 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -75.85 -17.38 59.84 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.8 0.333 . . . . 0.0 110.216 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' PHE . . . . . 0.565 ' HB3' ' CE2' ' A' ' 52' ' ' PHE . 56.4 m-85 -95.22 -18.61 20.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.4 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -97.8 -62.86 1.19 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.144 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -57.24 -48.02 79.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.18 0.514 . . . . 0.0 110.691 -175.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.489 HD13 ' O ' ' B' ' 109' ' ' LEU . 0.5 OUTLIER -70.91 -22.67 62.22 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.65 -176.089 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' PHE . . . . . 0.44 ' HE2' ' HA ' ' A' ' 32' ' ' ALA . 51.1 t80 -93.08 -43.33 8.93 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.078 -178.001 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -57.24 -43.47 82.96 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.26 -176.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 C--O 1.245 0.837 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.143 176.011 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.422 ' HG2' ' H ' ' A' ' 21' ' ' ASN . 0.9 OUTLIER . . . . . 0 C--O 1.234 0.269 0 CA-C-O 121.346 0.593 . . . . 0.0 110.877 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.422 ' H ' ' HG2' ' A' ' 20' ' ' GLU . 27.7 p-10 -176.87 -171.51 0.37 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.866 -1.061 . . . . 0.0 108.138 177.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.736 HG13 ' HA ' ' A' ' 59' ' ' THR . 45.3 t 61.11 54.78 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-O 122.022 0.915 . . . . 0.0 110.298 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.409 ' O ' ' HG3' ' A' ' 25' ' ' ARG . 2.4 tt -99.76 111.05 60.99 Favored Pre-proline 0 C--N 1.318 -0.764 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.708 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 52.4 Cg_exo -56.59 98.14 0.07 OUTLIER 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.91 2.406 . . . . 0.0 112.599 -178.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 23' ' ' LEU . 82.4 mtp180 -128.42 95.95 4.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.632 -176.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.607 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 34.6 tt0 -56.32 -42.99 99.02 Favored Pre-proline 0 CA--C 1.541 0.616 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.607 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 9.0 Cg_endo -52.63 -30.08 44.02 Favored 'Trans proline' 0 C--N 1.358 1.05 0 C-N-CA 122.033 1.822 . . . . 0.0 112.537 176.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.649 HD22 HD13 ' A' ' 58' ' ' LEU . 7.1 tt -71.17 -22.0 62.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.416 -178.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.673 HD11 ' HB3' ' A' ' 62' ' ' GLU . 47.4 mm -58.74 -46.53 90.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.723 0.297 . . . . 0.0 110.349 176.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.12 -44.59 95.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.103 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 34.7 m -57.44 -38.3 74.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.723 176.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.787 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -68.99 -48.81 62.19 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.389 -179.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 29' ' ' ILE . 89.1 t -59.47 -45.57 93.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 111.422 0.156 . . . . 0.0 111.422 -177.647 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.593 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 0.0 OUTLIER -69.27 -23.74 63.88 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.888 0.375 . . . . 0.0 110.584 179.404 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.525 ' HZ ' ' CD2' ' B' ' 106' ' ' PHE . 86.5 t80 -70.48 -54.66 11.38 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 109.389 -0.596 . . . . 0.0 109.389 174.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.787 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 33.3 mt -57.01 -55.52 33.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.427 -176.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -95.17 28.11 2.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.137 -175.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' A' ' 34' ' ' LYS . 15.5 t-20 -68.84 -50.6 48.6 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 173.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 27.4 p -173.49 -68.08 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.414 176.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 55.8 mtp180 -95.41 -20.22 19.27 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -169.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.525 HG23 ' HE2' ' B' ' 105' ' ' PHE . 48.9 t -63.86 -34.97 71.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 CA-C-N 118.022 0.374 . . . . 0.0 111.498 -174.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.413 ' HD2' HG21 ' A' ' 72' ' ' THR . 6.6 mmm180 -58.3 -29.85 66.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.882 0.373 . . . . 0.0 110.769 174.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -99.02 -5.19 30.84 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.521 -177.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 51.0 m -80.93 146.77 60.15 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.229 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.403 ' O ' ' HG3' ' A' ' 49' ' ' ARG . 54.1 Cg_exo -52.19 134.24 49.82 Favored 'Trans proline' 0 C--O 1.239 0.528 0 C-N-CA 123.023 2.482 . . . . 0.0 112.794 -178.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.464 ' O ' ' HG3' ' A' ' 50' ' ' ARG . 7.8 mp -64.07 -28.02 69.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.35 -175.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.17 -50.87 71.49 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.366 0.416 . . . . 0.0 110.528 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 98.9 m -57.42 -56.12 25.9 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.809 174.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.64 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 30.7 mtm180 -56.13 -43.49 78.24 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -170.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 46' ' ' LEU . 66.4 mtm180 -69.24 -48.48 61.78 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.591 0.234 . . . . 0.0 111.441 -174.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.452 ' O ' ' HG3' ' A' ' 55' ' ' LYS . . . -64.83 -38.29 90.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.258 0.551 . . . . 0.0 109.787 177.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.613 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 55.3 t80 -48.96 -67.56 0.26 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.735 -1.12 . . . . 0.0 112.393 179.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 49' ' ' ARG . 0.4 OUTLIER -68.11 -29.98 69.03 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -174.523 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.874 ' HE2' HD13 ' A' ' 63' ' ' ILE . 59.0 mttm -59.14 -42.12 89.92 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.112 0.482 . . . . 0.0 110.224 173.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 51' ' ' ALA . 28.8 mtpp -74.94 -30.64 61.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.395 -178.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.613 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 11.4 mmpt? -64.42 -27.13 68.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.356 0.598 . . . . 0.0 109.966 176.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 127.57 65.92 0.14 Allowed Glycine 0 N--CA 1.443 -0.881 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.182 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.715 ' HG ' ' HB2' ' A' ' 62' ' ' GLU . 11.8 tp -151.23 144.51 24.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.002 0.43 . . . . 0.0 110.511 -178.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.736 ' HA ' HG13 ' A' ' 22' ' ' VAL . 2.7 m -87.94 166.51 14.46 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.97 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.58 ' O ' HG12 ' A' ' 63' ' ' ILE . 4.6 m-20 -50.77 -57.7 7.72 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 122.88 0.472 . . . . 0.0 111.779 178.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.442 ' HA ' ' OD2' ' A' ' 64' ' ' ASP . 7.7 pt-20 -58.52 -27.63 64.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.756 -177.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.715 ' HB2' ' HG ' ' A' ' 58' ' ' LEU . 51.8 mt-10 -79.9 -28.17 39.86 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.854 -178.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.874 HD13 ' HE2' ' A' ' 54' ' ' LYS . 3.2 pt -70.11 -34.15 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 C-N-CA 119.952 -0.699 . . . . 0.0 109.758 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.442 ' OD2' ' HA ' ' A' ' 61' ' ' GLU . 3.0 p30 -77.3 -26.02 51.88 Favored 'General case' 0 C--O 1.21 -0.996 0 C-N-CA 119.532 -0.867 . . . . 0.0 110.223 173.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.642 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 0.3 OUTLIER -56.69 -50.94 70.65 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 119.599 -0.84 . . . . 0.0 108.786 173.318 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.42 -57.68 6.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.456 178.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.64 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 3.6 m-85 -66.13 -38.49 88.28 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -173.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -65.68 -45.75 81.68 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -178.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -77.24 -21.26 54.02 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.258 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 32.5 t -79.6 -14.9 58.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.67 0.271 . . . . 0.0 110.37 176.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 80.37 28.37 48.61 Favored Glycine 0 C--N 1.333 0.368 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.78 176.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.619 HG23 ' HD1' ' A' ' 67' ' ' PHE . 10.2 t -145.52 48.22 1.26 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.107 0.956 . . . . 0.0 110.467 -179.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -91.37 -26.23 19.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.15 178.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . 70.69 -75.91 0.07 Allowed 'General case' 0 N--CA 1.463 0.202 0 O-C-N 124.349 1.031 . . . . 0.0 111.852 177.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.415 ' HB2' ' H ' ' A' ' 76' ' ' GLU . 6.7 m-20 -124.78 -93.8 0.49 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.048 0.452 . . . . 0.0 110.773 -176.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.415 ' H ' ' HB2' ' A' ' 75' ' ' ASP . 8.5 pt-20 . . . . . 0 C--N 1.326 -0.438 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.012 -177.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 18.2 m . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 121.229 0.537 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -84.17 -49.65 8.64 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.913 -175.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -74.31 -31.13 62.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.877 -178.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -55.45 -36.95 67.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.136 0.493 . . . . 0.0 110.155 172.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' PHE . . . . . 0.525 ' HE2' HG23 ' A' ' 41' ' ' VAL . 33.4 t80 -69.57 -42.3 74.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.66 -177.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' PHE . . . . . 0.525 ' CD2' ' HZ ' ' A' ' 35' ' ' PHE . 37.8 m-85 -75.92 -38.29 57.85 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -178.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.3 -60.16 2.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.238 -172.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -61.09 -49.97 75.17 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -171.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.593 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 72.6 mt -58.5 -33.96 70.4 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.735 0.302 . . . . 0.0 111.429 -176.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' PHE . . . . . 0.679 ' HE2' ' HA ' ' A' ' 32' ' ' ALA . 6.1 t80 -92.02 -5.95 52.01 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.212 -174.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -73.83 -23.68 59.68 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.816 -178.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.987 -0.53 . . . . 0.0 109.762 176.124 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 . . . . . 0 C--O 1.234 0.28 0 CA-C-O 120.717 0.294 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -78.25 56.32 1.67 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.467 0.651 . . . . 0.0 109.885 178.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.0 p -133.13 6.33 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.044 175.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 24' ' ' PRO . 41.3 tp -57.26 109.54 1.81 Allowed Pre-proline 0 C--O 1.233 0.232 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.611 -174.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.473 ' HA ' ' O ' ' A' ' 57' ' ' GLY . 21.5 Cg_exo -67.2 132.42 27.72 Favored 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 123.3 2.666 . . . . 0.0 111.878 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.424 ' HB2' ' HB2' ' A' ' 28' ' ' LEU . 74.4 mtt180 -119.71 160.79 21.87 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.685 179.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.612 ' HB2' ' HD3' ' A' ' 27' ' ' PRO . 39.4 mt-10 -66.18 -55.05 22.41 Favored Pre-proline 0 CA--C 1.539 0.527 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -174.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.612 ' HD3' ' HB2' ' A' ' 26' ' ' GLU . 86.1 Cg_endo -78.85 -16.87 12.57 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 122.083 1.855 . . . . 0.0 112.72 -175.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.424 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 3.4 tt -65.72 -30.52 71.2 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.239 -175.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 59.7 mt -64.68 -37.76 80.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.125 0.488 . . . . 0.0 110.082 175.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.477 ' HA ' HG12 ' A' ' 33' ' ' VAL . . . -70.81 -39.15 73.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.519 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.6 m -61.13 -39.48 90.2 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 121.024 0.44 . . . . 0.0 110.041 174.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.733 ' O ' ' HG ' ' A' ' 36' ' ' LEU . . . -66.93 -49.13 66.47 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.436 179.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.477 HG12 ' HA ' ' A' ' 30' ' ' ALA . 9.8 p -64.34 -35.22 73.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.615 -178.418 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.535 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 4.6 tmmm? -59.09 -52.26 66.52 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 172.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.505 ' HZ ' ' CD2' ' B' ' 106' ' ' PHE . 85.9 t80 -50.95 -52.8 38.76 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.571 179.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.733 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 39.3 mt -59.63 -40.38 87.44 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.764 -176.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.407 HE21 ' HA ' ' A' ' 70' ' ' SER . 95.8 mt-30 -85.95 32.01 0.61 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -172.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -101.71 28.99 5.18 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.239 0.542 . . . . 0.0 109.683 170.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.3 m 70.56 -66.95 0.26 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 114.711 -1.132 . . . . 0.0 112.339 175.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -57.54 -36.12 71.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.635 -173.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.678 HG12 ' HD3' ' A' ' 49' ' ' ARG . 51.5 t -63.03 -44.62 99.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.406 -176.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.514 ' HD2' ' CG2' ' A' ' 72' ' ' THR . 32.9 mtm180 -67.35 -18.76 65.28 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.007 0.432 . . . . 0.0 110.337 -177.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -96.73 -0.87 47.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.682 178.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.6 m -88.22 153.18 51.17 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.289 175.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -60.97 142.37 97.32 Favored 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 122.547 2.165 . . . . 0.0 112.579 -177.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 43.4 mt -63.11 -23.58 67.51 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.701 177.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -54.6 -47.59 73.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.355 174.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 73.7 m -70.49 -59.57 2.77 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.324 174.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.897 ' HB3' ' HZ ' ' A' ' 67' ' ' PHE . 41.0 mtm180 -52.94 -47.41 68.07 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -171.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.433 ' HG2' ' HE2' ' A' ' 67' ' ' PHE . 80.5 mtm180 -67.38 -52.74 36.39 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 121.156 -0.218 . . . . 0.0 111.46 -174.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.44 -34.68 78.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.148 0.499 . . . . 0.0 110.389 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.624 ' O ' ' HG2' ' A' ' 56' ' ' LYS . 49.8 t80 -54.88 -66.41 0.41 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.143 -0.935 . . . . 0.0 112.339 179.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 49' ' ' ARG . 0.5 OUTLIER -68.07 -23.73 64.98 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.713 -173.809 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.584 ' HA ' ' O ' ' A' ' 58' ' ' LEU . 97.4 mttt -63.15 -48.62 77.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.985 0.421 . . . . 0.0 110.683 173.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -67.85 -22.39 65.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.698 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.624 ' HG2' ' O ' ' A' ' 52' ' ' PHE . 11.4 mmpt? -69.78 -45.38 68.13 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.99 176.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.473 ' O ' ' HA ' ' A' ' 24' ' ' PRO . . . 150.79 62.73 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.206 -0.997 . . . . 0.0 113.724 176.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.59 HD11 HD13 ' A' ' 53' ' ' LEU . 3.0 pp -171.89 148.36 2.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.938 0.399 . . . . 0.0 110.75 173.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.625 HG22 ' H ' ' A' ' 60' ' ' ASP . 1.5 m -93.75 177.05 6.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.02 -177.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.681 ' O ' HG12 ' A' ' 63' ' ' ILE . 2.7 m-20 -49.81 -46.03 50.58 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -174.365 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 65' ' ' MET . 8.6 pt-20 -52.15 -40.29 61.2 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.163 0.506 . . . . 0.0 111.356 178.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.572 ' CB ' ' HB2' ' A' ' 58' ' ' LEU . 1.5 mp0 -77.45 -27.03 52.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.354 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.681 HG12 ' O ' ' A' ' 60' ' ' ASP . 2.4 pt -69.53 -39.62 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 120.269 -0.573 . . . . 0.0 110.158 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.54 -26.8 63.73 Favored 'General case' 0 C--O 1.211 -0.956 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 176.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.559 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 19.0 mmt -64.84 -49.9 68.76 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.227 175.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.72 -40.86 84.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.169 0.509 . . . . 0.0 110.365 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.897 ' HZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.8 m-85 -69.82 -28.56 65.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.194 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.3 tp60 -65.87 -50.06 65.9 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.037 0.446 . . . . 0.0 110.058 176.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -62.62 -36.94 84.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.888 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.407 ' HA ' HE21 ' A' ' 37' ' ' GLN . 32.4 p -83.86 0.23 48.48 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.572 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.91 37.19 94.28 Favored Glycine 0 C--N 1.334 0.433 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.738 177.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.514 ' CG2' ' HD2' ' A' ' 42' ' ' ARG . 35.9 p -125.15 19.33 8.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.074 0.464 . . . . 0.0 111.837 -176.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -77.13 71.45 3.62 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 174.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.66 -72.14 0.06 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.111 -0.95 . . . . 0.0 112.901 -173.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -129.77 -73.46 0.56 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.685 0.279 . . . . 0.0 110.443 -176.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 . . . . . 0 N--CA 1.446 -0.636 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 174.666 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' SER . . . . . . . . . . . . . 21.6 m . . . . . 0 N--CA 1.476 0.835 0 CA-C-O 120.761 0.315 . . . . 0.0 110.839 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -85.79 -31.83 22.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.839 0.352 . . . . 0.0 111.061 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -64.89 -34.25 77.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.729 0.3 . . . . 0.0 111.349 -177.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.59 ' HA ' ' HG2' ' B' ' 107' ' ' GLN . 0.1 OUTLIER -68.91 -18.75 64.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.894 179.609 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -70.78 -35.11 72.42 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.787 0.327 . . . . 0.0 110.228 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' PHE . . . . . 0.505 ' CD2' ' HZ ' ' A' ' 35' ' ' PHE . 12.3 m-85 -79.02 -33.48 44.8 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.526 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' GLN . . . . . 0.59 ' HG2' ' HA ' ' B' ' 104' ' ' LYS . 11.4 pt20 -91.65 -50.15 5.91 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -175.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' B' ' 107' ' ' GLN . 20.5 tt0 -78.58 -28.69 45.91 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 111.628 0.233 . . . . 0.0 111.628 -169.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.535 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 42.2 tp -69.66 -19.3 63.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.08 0.467 . . . . 0.0 110.161 178.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' PHE . . . . . 0.503 ' CE2' ' HA ' ' A' ' 32' ' ' ALA . 2.3 t80 -97.16 -5.2 37.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.855 -179.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -63.33 -52.48 61.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.385 0.612 . . . . 0.0 109.926 177.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 C--O 1.248 0.981 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.606 179.226 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 . . . . . 0 N--CA 1.458 -0.061 0 CA-C-O 121.243 0.544 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.482 ' O ' ' HA2' ' A' ' 57' ' ' GLY . 6.0 t30 -164.64 47.37 0.1 Allowed 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 175.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.6 t -119.26 59.67 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.871 -174.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 25' ' ' ARG . 1.0 OUTLIER -99.41 106.86 41.92 Favored Pre-proline 0 C--N 1.322 -0.619 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 176.676 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.544 ' HB3' ' HG2' ' A' ' 62' ' ' GLU . 28.7 Cg_endo -62.72 92.12 0.14 Allowed 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 122.824 2.349 . . . . 0.0 111.988 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.569 ' HB2' ' HB2' ' A' ' 28' ' ' LEU . 74.6 mtt180 -90.2 147.52 23.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.927 -177.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.469 ' N ' ' HD2' ' A' ' 27' ' ' PRO . 13.2 tp10 -61.97 -53.09 62.99 Favored Pre-proline 0 CA--C 1.539 0.533 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.131 -179.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 26' ' ' GLU . 26.8 Cg_endo -64.2 -20.14 66.71 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 121.993 1.796 . . . . 0.0 112.178 178.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.569 ' HB2' ' HB2' ' A' ' 25' ' ' ARG . 46.7 tp -67.78 -46.26 72.51 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.838 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 50.7 mm -64.12 -42.05 94.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.168 177.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.42 -43.19 93.1 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.181 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 31.7 m -67.91 -36.56 80.41 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.617 178.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.508 ' O ' HD13 ' A' ' 36' ' ' LEU . . . -61.7 -40.62 95.65 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.749 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 80.3 t -64.89 -43.21 96.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.807 0.337 . . . . 0.0 110.334 177.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.453 ' HE3' ' O ' ' B' ' 109' ' ' LEU . 5.4 tmtm? -55.87 -45.46 78.51 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.166 174.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.556 ' O ' HG21 ' A' ' 41' ' ' VAL . 78.5 t80 -60.96 -56.92 15.42 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.342 -0.844 . . . . 0.0 110.342 178.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.508 HD13 ' O ' ' A' ' 32' ' ' ALA . 0.6 OUTLIER -51.59 -42.02 61.62 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.342 -176.207 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -92.06 39.62 1.02 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.328 0.585 . . . . 0.0 111.926 -174.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.679 ' HB3' HG23 ' A' ' 41' ' ' VAL . 27.8 t-20 -88.21 6.45 36.67 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 167.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.442 ' HB3' ' O ' ' A' ' 38' ' ' ASN . 46.8 t 76.44 -60.74 0.47 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.792 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 77.6 mtt180 -69.15 -16.34 63.62 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -177.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.679 HG23 ' HB3' ' A' ' 38' ' ' ASN . 97.4 t -69.56 -32.41 52.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.854 0.359 . . . . 0.0 111.138 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 66.1 mtp180 -74.57 -33.19 62.63 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.126 177.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -76.75 -32.45 57.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.993 177.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 48.1 t -58.91 132.67 86.86 Favored Pre-proline 0 N--CA 1.45 -0.435 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.454 173.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -43.89 124.69 4.78 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.542 2.828 . . . . 0.0 113.04 -174.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.865 HD22 ' HB3' ' A' ' 75' ' ' ASP . 5.9 mp -69.54 -18.85 63.7 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.298 -179.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -52.06 -42.71 63.36 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 168.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.491 HG21 ' CE2' ' B' ' 106' ' ' PHE . 68.5 m -67.91 -41.26 82.94 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.263 173.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.708 ' CG ' ' HA ' ' A' ' 46' ' ' LEU . 13.4 mmp_? -53.07 -45.83 68.32 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.49 -176.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.579 ' O ' ' HE3' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -62.3 -57.62 10.69 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.834 -0.346 . . . . 0.0 111.644 -179.153 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.37 -42.63 96.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.125 0.488 . . . . 0.0 110.888 -178.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -59.48 -50.5 73.68 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.267 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.521 HD23 ' O ' ' A' ' 49' ' ' ARG . 1.8 mm? -60.29 -47.15 87.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.96 0.41 . . . . 0.0 110.622 179.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.811 ' HE2' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -64.87 -35.29 80.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.509 -178.434 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.404 ' HD3' ' HA ' ' A' ' 55' ' ' LYS . 31.8 mmtm -78.3 -23.28 47.21 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.879 ' HE2' ' HA ' ' A' ' 56' ' ' LYS . 0.1 OUTLIER -75.74 -11.07 59.92 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.605 0.241 . . . . 0.0 111.039 -177.843 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.482 ' HA2' ' O ' ' A' ' 21' ' ' ASN . . . 114.06 25.92 3.99 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.123 -1.036 . . . . 0.0 114.108 170.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.601 ' CD1' HG22 ' A' ' 63' ' ' ILE . 2.3 pp -135.87 139.39 43.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 117.396 0.598 . . . . 0.0 110.459 177.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.38 173.04 11.45 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.775 -176.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.679 ' O ' HG12 ' A' ' 63' ' ' ILE . 14.0 m-20 -52.06 -47.49 65.1 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -173.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -61.65 -28.5 69.43 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.369 -178.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.544 ' HG2' ' HB3' ' A' ' 24' ' ' PRO . 4.9 mp0 -74.98 -29.66 60.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.743 -0.208 . . . . 0.0 110.762 176.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.811 HD13 ' HE2' ' A' ' 54' ' ' LYS . 1.7 pt -69.96 -42.48 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 120.246 -0.582 . . . . 0.0 109.47 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.539 ' O ' ' HB2' ' A' ' 68' ' ' GLN . 9.8 m-20 -73.56 -16.13 61.27 Favored 'General case' 0 C--O 1.211 -0.963 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 177.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.414 ' O ' ' HB3' ' A' ' 68' ' ' GLN . 32.4 tpp -73.04 -50.29 23.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.888 0.375 . . . . 0.0 110.441 173.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -66.06 -39.47 90.13 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.308 0.575 . . . . 0.0 109.937 178.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.507 ' HE1' ' HG ' ' A' ' 36' ' ' LEU . 10.3 m-85 -72.91 -27.76 62.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.925 176.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.539 ' HB2' ' O ' ' A' ' 64' ' ' ASP . 22.3 tt0 -60.2 -54.65 43.29 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.488 0.661 . . . . 0.0 109.788 174.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -65.93 -27.12 67.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.983 -176.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.3 m -84.08 -9.7 58.4 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.017 177.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 68.75 36.85 83.41 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.367 178.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 41.0 p -115.29 86.21 2.41 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.947 0.403 . . . . 0.0 111.337 -176.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -97.79 -9.72 26.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.997 0.427 . . . . 0.0 110.299 175.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.97 127.23 31.26 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.722 176.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.865 ' HB3' HD22 ' A' ' 46' ' ' LEU . 32.8 t0 67.34 93.21 0.08 Allowed 'General case' 0 C--N 1.323 -0.566 0 O-C-N 124.451 1.095 . . . . 0.0 109.376 -172.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.449 -0.494 0 CA-C-N 114.599 -1.182 . . . . 0.0 112.961 -171.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' SER . . . . . 0.479 ' HB2' ' HG3' ' B' ' 104' ' ' LYS . 50.8 m . . . . . 0 N--CA 1.477 0.904 0 CA-C-O 120.646 0.26 . . . . 0.0 111.014 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -68.82 -25.88 64.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.999 0.428 . . . . 0.0 110.082 178.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -52.46 -40.13 61.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.196 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' LYS . . . . . 0.479 ' HG3' ' HB2' ' B' ' 101' ' ' SER . 81.5 mttt -66.98 -33.17 74.98 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.737 -178.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -62.59 -23.2 66.91 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.395 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' PHE . . . . . 0.491 ' CE2' HG21 ' A' ' 48' ' ' THR . 55.6 m-85 -96.22 -51.49 4.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.544 177.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -80.78 -46.71 14.97 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -173.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.77 -49.0 74.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.491 -173.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' LEU . . . . . 0.453 ' O ' ' HE3' ' A' ' 34' ' ' LYS . 89.4 mt -68.99 -9.81 54.25 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -175.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' PHE . . . . . 0.441 ' CE2' ' HA ' ' A' ' 32' ' ' ALA . 5.5 t80 -104.18 -5.9 21.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.109 0.481 . . . . 0.0 110.548 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -76.63 -26.15 54.61 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.966 0.412 . . . . 0.0 110.587 -175.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 64.9 m . . . . . 0 C--O 1.247 0.968 0 CA-C-O 118.603 -0.713 . . . . 0.0 110.131 176.095 . . . . . . . . 0 0 . 1 stop_ save_