data_2n3g_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 2n3g _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 ' 4' ' ' VAL . . . . . . . . . . . . . 17.6 m . . . . . 0 N--CA 1.455 -0.19 0 CA-C-O 120.67 0.272 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -58.33 -44.56 88.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.887 0.375 . . . . 0.0 111.112 -178.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -60.07 -42.91 95.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.009 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.53 -31.84 82.22 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 111.146 -0.781 . . . . 0.0 111.146 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -76.22 -46.92 25.95 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.671 0.272 . . . . 0.0 111.415 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 51.0 tp -62.35 -41.32 98.49 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.435 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -64.74 -43.09 94.46 Favored 'General case' 0 N--CA 1.44 -0.95 0 C-N-CA 119.821 -0.752 . . . . 0.0 110.323 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.51 -39.06 85.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.735 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE2' ' CE1' ' A' ' 16' ' ' HIS . 55.9 t80 -62.45 -52.45 63.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.729 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.69 -49.47 76.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.82 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.7 tp -63.47 -45.24 91.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.831 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -64.71 -39.86 94.37 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.542 -178.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE2' ' A' ' 12' ' ' TYR . 72.9 m80 -86.21 -7.3 58.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.67 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 63.1 t30 62.91 66.0 0.77 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.417 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.9 mt -127.55 148.18 50.34 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.641 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -44.71 137.22 4.02 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 121.07 0.462 . . . . 0.0 109.994 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.6 mt -48.98 144.3 7.64 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.732 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.53 154.7 55.25 Favored 'Trans proline' 0 N--CA 1.495 1.607 0 C-N-CA 122.398 2.065 . . . . 0.0 111.979 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.8 t -130.04 130.63 66.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-O 121.246 0.546 . . . . 0.0 110.792 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -106.9 152.89 23.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.874 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -116.6 143.74 45.24 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.547 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -121.2 124.81 45.6 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 120.691 0.281 . . . . 0.0 111.197 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -134.73 132.79 39.23 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 . . . . . 0 CA--C 1.516 -0.358 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 -179.663 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 85.9 mtt85 . . . . . 0 CA--C 1.516 -0.362 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -114.48 103.34 10.94 Favored 'General case' 0 CA--C 1.501 -0.941 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.112 179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -102.76 107.17 17.95 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.522 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.414 ' O ' ' OE1' ' A' ' 48' ' ' GLN . 69.8 m -113.26 129.82 56.42 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.427 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.421 ' OD1' ' OE1' ' A' ' 48' ' ' GLN . 60.0 m-80 -105.56 150.85 25.01 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.77 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.0 p -120.36 119.68 60.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 98.5 m -97.32 122.3 40.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.307 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -144.64 135.95 25.31 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.324 -0.398 . . . . 0.0 109.965 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.492 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 43.4 t 47.35 36.3 4.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.925 0.393 . . . . 0.0 110.907 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . 0.454 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 69.56 32.11 71.09 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.332 -0.707 . . . . 0.0 111.332 179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.454 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 98.8 mm-40 -135.17 128.27 31.73 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.731 0.301 . . . . 0.0 110.39 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 55.2 p -107.53 106.83 17.39 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.979 0.419 . . . . 0.0 111.129 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -92.72 141.71 28.16 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.039 179.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.421 ' OE1' ' OD1' ' A' ' 39' ' ' ASN . 69.9 tp60 -152.89 145.55 24.27 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.416 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 92.6 p -86.94 161.2 18.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.412 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.0 p -88.65 -4.05 58.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.895 0.378 . . . . 0.0 110.101 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -112.96 146.62 38.69 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.516 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.68 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -99.96 135.85 40.77 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 121.893 0.854 . . . . 0.0 109.538 -179.97 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.456 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -89.59 150.72 44.83 Favored Pre-proline 0 C--N 1.307 -1.259 0 CA-C-N 114.119 -1.401 . . . . 0.0 110.723 -179.544 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -79.76 -4.57 13.52 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 C-N-CA 122.496 2.13 . . . . 0.0 112.465 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.42 153.44 51.79 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.936 0.398 . . . . 0.0 111.02 -179.145 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.23 -62.82 1.32 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.657 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -55.66 -32.91 63.62 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 120.802 0.334 . . . . 0.0 110.734 -177.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.2 t -56.84 -37.79 71.76 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.829 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.14 -41.71 81.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.057 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -63.5 -44.05 95.48 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.753 0.311 . . . . 0.0 110.841 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 32.7 m-70 -62.06 -48.03 82.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.394 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.52 -36.01 81.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.533 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.65 -48.19 81.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.369 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.68 -33.32 75.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.953 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -54.97 -47.33 74.69 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.614 0.245 . . . . 0.0 111.061 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.4 pt -74.08 -32.21 32.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.5 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.446 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -68.37 -50.29 54.18 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.769 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 p -65.1 -29.98 48.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.743 0.306 . . . . 0.0 110.502 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.24 -33.59 73.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.916 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.446 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 86.1 p . . . . . 0 C--N 1.331 -0.21 0 CA-C-O 120.956 0.408 . . . . 0.0 110.566 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.2 m . . . . . 0 N--CA 1.453 -0.293 0 CA-C-O 120.737 0.303 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -57.91 -44.82 87.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.719 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -58.1 -42.54 85.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.365 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -66.92 -29.74 75.08 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -77.22 -49.3 15.42 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.009 0.433 . . . . 0.0 111.264 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 56.2 tp -62.84 -41.82 99.5 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.445 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -64.7 -40.41 95.32 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 119.538 -0.865 . . . . 0.0 110.611 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.32 -38.32 81.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.557 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -62.13 -49.78 74.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.803 -179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.412 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -57.33 -47.88 80.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.881 0.372 . . . . 0.0 110.39 -179.518 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.2 tp -61.89 -46.2 90.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.615 -179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -65.7 -39.59 91.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.781 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.499 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 60.0 t-80 -88.37 -0.87 57.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.601 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.412 ' N ' ' O ' ' A' ' 13' ' ' ALA . 80.7 m-20 56.17 65.54 1.41 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.671 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 81.7 mt -127.07 148.87 50.13 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.413 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -46.34 134.58 8.79 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.752 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.3 mt -46.91 144.8 3.56 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.692 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.89 153.5 63.72 Favored 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 122.215 1.944 . . . . 0.0 111.878 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 73.6 t -129.83 130.43 66.52 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.339 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -106.37 152.77 23.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.41 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.527 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -117.53 140.54 49.48 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.279 178.289 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -119.47 125.66 49.44 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.962 0.41 . . . . 0.0 111.319 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -135.0 133.84 39.86 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.061 178.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 69.8 ttp85 . . . . . 0 CA--C 1.518 -0.279 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.172 -179.653 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 91.1 mtm180 . . . . . 0 CA--C 1.516 -0.359 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -113.67 103.55 11.34 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.217 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -99.62 106.33 18.29 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.527 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 45.1 t -112.23 124.42 52.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.489 -179.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -107.77 151.58 25.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.079 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.0 p -120.59 120.03 61.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.303 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.165 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 87.2 m -96.07 121.42 37.8 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.283 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.556 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 5.0 t80 -142.18 138.99 31.93 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.189 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.556 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 4.0 m 45.25 31.98 0.9 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.743 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 74.88 32.17 57.22 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 42' ' ' PHE . 86.6 mt-30 -136.59 126.76 26.29 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 45.7 p -104.86 106.89 17.58 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.957 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.491 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 51.8 m-85 -91.3 140.95 29.3 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.201 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -150.1 150.77 32.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.372 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.69 ' HG ' ' H ' ' A' ' 51' ' ' GLU . 29.3 t -91.31 164.38 13.88 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.515 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.8 m -89.41 -7.39 55.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.584 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.69 ' H ' ' HG ' ' A' ' 49' ' ' SER . 96.4 mt-10 -117.66 136.9 53.02 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.323 0.582 . . . . 0.0 110.188 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.526 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -90.22 144.13 26.13 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.55 -179.07 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -95.61 148.97 35.44 Favored Pre-proline 0 C--N 1.317 -0.806 0 CA-C-N 114.757 -1.11 . . . . 0.0 111.174 -179.66 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -80.37 -3.81 12.74 Favored 'Trans proline' 0 N--CA 1.494 1.547 0 C-N-CA 122.848 2.365 . . . . 0.0 111.941 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.433 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -130.14 154.02 47.92 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.228 0.537 . . . . 0.0 110.822 -179.346 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.1 tt -70.25 -64.99 0.78 Allowed 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.475 -178.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -55.19 -35.53 64.92 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 120.98 0.419 . . . . 0.0 110.554 -178.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.433 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 58.3 m -55.32 -34.8 64.51 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.016 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.81 -40.3 72.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.782 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -63.03 -41.25 99.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.331 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -63.76 -49.22 73.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.794 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.57 -35.43 79.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.926 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.94 -48.64 79.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.783 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.47 -33.53 74.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.053 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -54.9 -45.24 74.69 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.685 0.279 . . . . 0.0 111.456 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 22.1 pt -73.27 -33.94 42.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.578 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.59 -50.52 43.81 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.705 -178.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.9 p -63.49 -32.26 56.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.188 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.25 -30.24 68.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.715 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.491 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 15.7 m . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.762 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.7 m . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 120.742 0.306 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -56.45 -46.17 80.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.804 -179.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -60.83 -41.98 96.85 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.632 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.85 -33.44 85.79 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -77.74 -49.87 13.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.237 0.541 . . . . 0.0 111.235 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 29.5 tp -62.09 -42.32 99.09 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.169 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -62.85 -41.89 99.54 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.683 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.83 -36.54 80.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.49 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.621 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 83.1 t80 -61.22 -50.61 72.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.816 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.41 -51.53 69.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.904 0.383 . . . . 0.0 110.663 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 51.2 tp -62.85 -44.12 96.99 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.732 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 69.8 tp60 -64.11 -38.49 91.25 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.569 -178.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 68.1 m80 -91.78 -0.46 57.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.718 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 64.7 t30 58.04 66.33 1.13 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.592 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.9 mt -127.93 146.62 50.58 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.017 0.437 . . . . 0.0 110.575 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 57.0 mp0 -42.62 133.4 3.44 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.103 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.404 ' N ' ' CD1' ' A' ' 20' ' ' LEU . 10.5 mp -47.2 145.55 3.55 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.691 -178.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.42 153.71 55.6 Favored 'Trans proline' 0 N--CA 1.492 1.441 0 C-N-CA 122.497 2.131 . . . . 0.0 111.881 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 67.3 t -128.85 131.87 67.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.324 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -107.34 152.88 23.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.672 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -115.91 144.47 44.0 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.456 178.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -124.95 123.6 40.23 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.288 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 83.9 mt-10 -133.87 130.72 38.24 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 . . . . . 0 CA--C 1.517 -0.322 0 CA-C-O 120.788 0.328 . . . . 0.0 110.286 -179.538 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 87.5 mtm180 . . . . . 0 CA--C 1.515 -0.392 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -114.22 103.78 11.44 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.036 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -102.34 105.36 15.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.12 0.486 . . . . 0.0 109.731 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 69.0 m -114.08 132.93 55.86 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.452 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -111.41 155.52 23.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.293 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.9 p -121.11 119.9 60.62 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.301 0 CA-C-O 120.923 0.392 . . . . 0.0 109.95 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 74.8 m -97.33 124.88 41.61 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.681 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -146.08 136.83 24.29 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.125 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.441 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 49.6 t 46.76 32.82 1.88 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.808 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . 0.45 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 74.11 32.85 57.98 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 111.236 -0.745 . . . . 0.0 111.236 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 98.8 mm-40 -136.56 123.62 21.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.804 0.335 . . . . 0.0 110.217 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.2 p -106.13 108.73 20.4 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.115 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -94.5 141.6 28.4 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.007 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -147.86 145.91 28.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.892 0.377 . . . . 0.0 110.422 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.437 ' HG ' ' H ' ' A' ' 51' ' ' GLU . 6.1 p -84.7 163.18 19.36 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.307 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.1 p -90.86 -2.51 57.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.536 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.437 ' H ' ' HG ' ' A' ' 49' ' ' SER . 97.3 mt-10 -118.29 154.43 32.3 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.222 0.534 . . . . 0.0 110.105 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.687 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -103.68 134.26 47.31 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.909 -179.405 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.43 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -88.02 147.54 40.99 Favored Pre-proline 0 C--N 1.311 -1.107 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.935 -179.838 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.15 -5.33 16.16 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.759 2.306 . . . . 0.0 112.381 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.435 ' O ' ' OG ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -136.06 155.79 49.69 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.001 0.429 . . . . 0.0 111.107 -179.216 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.97 -64.13 0.92 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.93 -178.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -54.22 -36.17 63.22 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.937 -177.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.435 ' OG ' ' O ' ' A' ' 55' ' ' THR . 77.8 p -56.05 -33.02 64.58 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.14 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.67 -42.24 67.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.896 0.379 . . . . 0.0 111.128 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -64.21 -42.14 96.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.532 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 43.7 m-70 -66.17 -46.8 76.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.718 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.66 -37.98 83.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.762 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.25 -45.47 94.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.687 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.6 -37.07 77.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.364 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.36 -50.03 75.1 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.356 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 96.6 mt -57.82 -47.78 85.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.216 -178.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.6 -43.88 88.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.008 0.432 . . . . 0.0 110.501 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.2 t -59.48 -41.21 83.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.142 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.08 -29.88 70.78 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.652 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.793 -179.929 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.5 m . . . . . 0 N--CA 1.454 -0.243 0 N-CA-C 110.452 -0.203 . . . . 0.0 110.452 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -60.31 -44.94 94.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.796 0.332 . . . . 0.0 110.815 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -59.1 -41.66 88.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.533 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.6 -28.01 73.44 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -77.64 -49.61 14.18 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.021 0.438 . . . . 0.0 111.018 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.1 tp -61.63 -42.16 98.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.723 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -62.23 -40.14 95.17 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.833 -179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.28 -38.07 78.18 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.408 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.618 ' CE1' ' CD2' ' A' ' 16' ' ' HIS . 83.9 t80 -62.05 -51.7 66.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.609 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.492 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.81 -49.21 76.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.514 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 51.5 tp -62.41 -44.79 95.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.636 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -65.35 -39.48 92.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.588 -179.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.618 ' CD2' ' CE1' ' A' ' 12' ' ' TYR . 66.5 m-70 -90.28 -5.71 55.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.6 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.492 ' N ' ' O ' ' A' ' 13' ' ' ALA . 64.5 t30 60.72 67.12 0.85 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.559 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 75.7 mt -126.66 148.12 49.86 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.937 0.398 . . . . 0.0 110.584 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.481 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 55.4 mp0 -42.51 131.92 3.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.269 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 pp -46.08 144.57 2.93 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.635 -179.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -72.53 155.42 54.93 Favored 'Trans proline' 0 C--N 1.308 -1.585 0 C-N-CA 122.769 2.313 . . . . 0.0 112.167 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 59.1 t -130.69 132.02 64.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.458 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -108.88 153.54 23.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.765 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -116.16 144.06 44.67 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.817 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -123.61 122.91 39.37 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.937 -179.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -132.39 126.84 34.1 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.735 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 . . . . . 0 C--O 1.235 0.295 0 CA-C-O 120.844 0.354 . . . . 0.0 110.374 -179.507 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 85.0 mtt85 . . . . . 0 CA--C 1.516 -0.36 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -113.65 104.03 11.82 Favored 'General case' 0 C--O 1.217 -0.635 0 C-N-CA 120.479 -0.488 . . . . 0.0 111.335 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -106.21 104.38 14.07 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 81.2 m -113.08 133.53 54.96 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.309 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -111.34 153.98 25.21 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.313 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.4 p -121.3 119.7 59.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 121.032 0.444 . . . . 0.0 110.159 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 98.0 m -97.07 123.3 40.78 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.788 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -145.26 136.95 25.39 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.325 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.492 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 43.9 t 46.54 36.05 3.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.528 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . 0.433 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 70.56 32.77 67.48 Favored Glycine 0 CA--C 1.52 0.371 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.433 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 98.2 mm-40 -136.25 125.54 24.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.722 0.296 . . . . 0.0 110.342 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.0 p -106.83 107.54 18.61 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.965 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.526 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 54.5 m-85 -92.85 140.94 28.98 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.008 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -147.65 151.08 35.58 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.392 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.6 m -88.74 160.68 17.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.463 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 86.8 p -86.37 -7.74 58.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.548 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -127.64 132.16 49.78 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.412 0.625 . . . . 0.0 110.771 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -80.28 148.75 30.61 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.136 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.556 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -98.1 149.69 35.99 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.875 -179.756 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -75.68 -4.39 15.17 Favored 'Trans proline' 0 C--N 1.311 -1.41 0 C-N-CA 122.764 2.309 . . . . 0.0 112.357 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.473 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -130.54 153.23 49.07 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.235 0.541 . . . . 0.0 110.722 -179.343 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.1 tt -69.7 -66.46 0.59 Allowed 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.293 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -53.41 -36.59 61.65 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.515 -178.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.473 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 79.1 p -54.73 -32.38 59.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.284 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.27 -40.73 70.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.856 0.36 . . . . 0.0 110.813 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -64.91 -38.67 91.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.477 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 22.9 m170 -64.58 -51.77 61.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.81 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.38 -34.33 77.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.645 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.19 -46.76 85.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.639 -179.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.03 -32.71 70.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.651 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -54.18 -45.34 72.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.825 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.8 pt -74.22 -32.87 33.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.068 0.461 . . . . 0.0 110.804 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.18 -50.27 41.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.239 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.6 p -64.36 -31.18 52.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.626 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.42 -28.78 65.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.524 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.526 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 15.6 m . . . . . 0 C--N 1.329 -0.295 0 CA-C-O 121.063 0.458 . . . . 0.0 110.661 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 24.1 m . . . . . 0 N--CA 1.457 -0.095 0 CA-C-O 120.701 0.286 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -59.19 -44.37 92.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.834 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -58.51 -43.09 88.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.258 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.41 -28.27 73.33 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 111.234 -0.746 . . . . 0.0 111.234 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -77.4 -49.58 14.58 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.88 0.372 . . . . 0.0 110.978 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 59.0 tp -63.21 -41.2 99.1 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.323 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -62.49 -41.28 98.69 Favored 'General case' 0 C--N 1.311 -1.101 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.623 -179.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.09 -37.85 81.68 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.934 179.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 80.5 t80 -61.67 -51.22 69.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.775 -179.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.32 -48.5 80.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.434 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.3 tp -62.73 -44.24 96.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.469 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.9 tp60 -65.24 -40.19 93.71 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.601 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 69.1 m80 -89.55 -1.69 58.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.692 -179.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 60.9 t-20 58.59 65.95 1.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.546 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.8 mt -127.4 151.15 49.17 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.583 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -45.58 129.52 8.75 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.722 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.35 146.27 2.4 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.598 -178.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.26 152.88 66.97 Favored 'Trans proline' 0 N--CA 1.494 1.501 0 C-N-CA 122.396 2.064 . . . . 0.0 112.041 179.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.1 t -129.83 129.39 66.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.535 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -104.73 152.61 22.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.331 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.515 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -117.93 145.24 44.82 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.526 178.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -121.5 125.62 47.26 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.665 0.269 . . . . 0.0 111.245 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -134.69 123.64 24.02 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 . . . . . 0 CA--C 1.512 -0.501 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 -179.834 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.401 ' NH2' ' CD1' ' A' ' 52' ' ' PHE . 82.8 mtp180 . . . . . 0 CA--C 1.515 -0.379 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -114.96 103.83 11.31 Favored 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 120.161 -0.616 . . . . 0.0 111.296 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.7 mtm180 -101.77 106.36 17.35 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.077 0.465 . . . . 0.0 110.226 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.515 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 42.1 t -109.79 124.5 51.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.375 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -106.63 150.55 26.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.711 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.4 p -119.28 119.46 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.11 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 94.8 m -94.66 120.19 34.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.212 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.486 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 4.5 t80 -141.36 138.01 32.74 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.203 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.486 ' SG ' ' O ' ' A' ' 42' ' ' PHE . 13.8 p 41.9 44.13 2.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.945 0.402 . . . . 0.0 110.718 179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 64.64 32.63 84.84 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.443 ' N ' ' O ' ' A' ' 42' ' ' PHE . 47.6 tp60 -137.73 122.51 18.76 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.912 0.387 . . . . 0.0 110.384 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 32.7 p -103.69 109.08 20.64 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.129 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.499 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 15.9 m-85 -89.9 140.74 29.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.859 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -144.95 154.01 42.13 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.341 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.1 m -98.62 159.85 14.67 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.415 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 93.7 p -89.88 -6.88 55.35 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.56 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -116.26 148.88 40.03 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.146 0.498 . . . . 0.0 110.189 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.689 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -101.59 131.26 47.88 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-N 115.228 -0.897 . . . . 0.0 109.822 -179.331 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.462 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -85.98 148.84 49.06 Favored Pre-proline 0 C--N 1.307 -1.247 0 CA-C-N 114.142 -1.39 . . . . 0.0 110.688 -179.566 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -77.42 -5.17 15.39 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 122.395 2.064 . . . . 0.0 112.563 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 48.7 m -135.43 153.09 51.9 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.255 0.55 . . . . 0.0 111.179 -179.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.7 -62.56 1.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.554 -178.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.47 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 69.0 mttm -55.07 -33.63 62.91 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 120.992 0.425 . . . . 0.0 110.601 -177.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.4 t -56.46 -36.93 69.62 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.003 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.87 -41.62 74.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.7 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -61.13 -40.81 95.2 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.42 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.603 ' ND1' ' N ' ' A' ' 61' ' ' HIS . 0.4 OUTLIER -67.5 -44.87 77.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.656 -179.525 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.92 -40.85 87.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.074 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.77 -50.68 72.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.682 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.33 -37.73 84.34 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.351 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -55.81 -45.89 78.17 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.881 0.372 . . . . 0.0 110.324 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.62 -43.82 93.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.862 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.437 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -67.24 -49.56 64.01 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.4 p -65.05 -31.77 55.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.175 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.95 -27.56 65.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.633 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 59.7 p . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.599 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 32.7 m . . . . . 0 N--CA 1.452 -0.354 0 CA-C-O 120.574 0.226 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -55.77 -43.74 77.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.828 0.346 . . . . 0.0 110.923 -178.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -59.88 -42.59 94.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.437 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -74.55 -26.32 67.95 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.66 -0.576 . . . . 0.0 111.66 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -77.17 -49.02 16.1 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.655 0.264 . . . . 0.0 111.506 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.6 tp -63.58 -41.37 98.38 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.179 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -65.12 -42.13 94.22 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.257 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.14 -37.57 84.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.667 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 92.4 t80 -61.5 -48.93 78.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.657 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.441 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.82 -45.83 82.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.798 0.332 . . . . 0.0 110.521 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.3 tp -62.86 -46.17 89.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.729 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -66.04 -42.68 89.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.966 0.413 . . . . 0.0 110.627 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.481 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 66.9 t-80 -84.8 -5.43 59.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.831 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.441 ' N ' ' O ' ' A' ' 13' ' ' ALA . 61.7 t-20 58.66 65.46 1.24 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.716 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.5 mt -123.38 148.37 46.14 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.683 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -41.72 152.64 0.07 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.302 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.445 ' CD2' ' N ' ' A' ' 20' ' ' LEU . 3.6 mm? -61.61 139.43 95.18 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.468 -178.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -72.07 152.89 57.32 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 122.362 2.042 . . . . 0.0 112.013 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 72.2 t -131.45 130.96 63.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.935 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -107.28 152.22 24.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.422 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.512 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -115.94 141.53 47.99 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 115.602 -0.727 . . . . 0.0 109.133 178.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -119.8 125.14 47.84 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.751 0.31 . . . . 0.0 111.353 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -134.01 128.69 34.87 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 . . . . . 0 CA--C 1.512 -0.482 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -179.533 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 . . . . . 0 N--CA 1.464 0.251 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -114.54 103.07 10.65 Favored 'General case' 0 CA--C 1.498 -1.029 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.963 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.9 mmm-85 -101.31 107.41 18.76 Favored 'General case' 0 C--N 1.316 -0.856 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.386 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.512 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 43.7 t -111.85 126.21 54.85 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.787 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -106.36 152.98 22.87 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 p -121.14 120.4 62.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.279 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 52.1 m -98.22 120.44 38.64 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.913 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.497 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 6.3 t80 -144.06 137.35 27.53 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.264 -0.425 . . . . 0.0 109.988 -179.689 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.497 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 7.6 m 47.46 40.04 10.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.832 0.349 . . . . 0.0 110.754 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 66.02 31.72 80.31 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 111.598 -0.601 . . . . 0.0 111.598 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -135.83 126.01 26.31 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.746 0.307 . . . . 0.0 110.355 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 27.6 m -107.51 108.83 20.32 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.877 0.37 . . . . 0.0 110.852 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -93.31 141.92 27.9 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.744 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -142.94 144.23 32.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.593 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.5 p -84.11 162.19 20.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.634 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.7 p -93.3 -7.53 44.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.225 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -116.96 152.58 34.27 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.364 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.699 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -103.73 132.48 49.94 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.85 0.833 . . . . 0.0 109.735 -179.671 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.442 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -87.48 149.42 46.58 Favored Pre-proline 0 C--N 1.303 -1.423 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.454 -179.855 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.12 -5.1 14.91 Favored 'Trans proline' 0 N--CA 1.494 1.515 0 C-N-CA 122.588 2.192 . . . . 0.0 112.704 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 51.6 m -135.09 150.95 50.32 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.875 0.369 . . . . 0.0 111.201 -178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.31 -61.73 2.16 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.734 -178.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.523 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 68.8 mttm -54.95 -34.44 63.27 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 120.792 0.33 . . . . 0.0 110.91 -178.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.2 t -55.57 -38.42 69.33 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.066 0.46 . . . . 0.0 109.849 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.59 -41.68 79.28 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.345 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -64.12 -43.67 94.58 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.764 0.316 . . . . 0.0 110.821 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.523 ' CD2' ' O ' ' A' ' 57' ' ' LYS . 84.8 m-70 -67.38 -45.61 75.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.674 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.0 -40.37 87.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.2 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.01 -45.37 93.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.839 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.95 -38.19 78.48 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.527 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -57.83 -48.45 79.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.789 179.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.6 mt -57.87 -48.88 82.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.166 -178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.03 -43.47 92.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.639 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 20.8 t -59.14 -42.58 87.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 109.994 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.99 -29.86 71.15 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.929 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.8 t . . . . . 0 CA--C 1.53 0.192 0 CA-C-O 120.876 0.369 . . . . 0.0 111.285 179.767 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.9 m . . . . . 0 N--CA 1.455 -0.215 0 CA-C-O 120.61 0.243 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.418 ' CD1' ' N ' ' A' ' 5' ' ' TYR . 6.0 m-85 -61.43 -42.79 99.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.8 0.334 . . . . 0.0 111.063 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -59.33 -39.6 83.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.412 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.28 -24.34 59.36 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -77.28 -50.1 13.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.149 0.5 . . . . 0.0 110.859 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.5 tp -63.27 -41.79 99.06 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.328 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.0 tp-100 -60.79 -41.3 95.3 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 120.086 -0.645 . . . . 0.0 110.803 -178.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.67 -37.3 86.12 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.426 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 81.0 t80 -61.35 -49.87 75.21 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.898 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.488 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.96 -49.39 75.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.953 0.406 . . . . 0.0 110.293 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.2 tp -62.78 -44.25 96.66 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.581 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -64.17 -37.32 87.05 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.698 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 59.3 m80 -94.83 -2.36 50.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.7 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 13' ' ' ALA . 55.2 t-20 59.29 66.57 1.01 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.715 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 71.5 mt -124.49 149.96 46.29 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.459 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -46.06 134.58 8.16 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.906 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.91 146.73 2.57 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.745 -178.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.36 154.66 45.93 Favored 'Trans proline' 0 N--CA 1.496 1.631 0 C-N-CA 122.758 2.306 . . . . 0.0 112.354 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.0 t -129.9 130.38 66.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.379 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -107.42 152.34 24.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.857 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -119.68 134.87 55.06 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -115.59 125.68 53.25 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.983 0.42 . . . . 0.0 111.516 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -129.83 127.75 40.91 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.515 178.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 . . . . . 0 CA--C 1.515 -0.371 0 CA-C-O 120.657 0.265 . . . . 0.0 110.314 -179.546 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 87.5 mtm180 . . . . . 0 CA--C 1.514 -0.408 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -113.78 104.13 11.9 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.461 -0.496 . . . . 0.0 111.144 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.584 ' NH2' ' NE2' ' A' ' 48' ' ' GLN . 81.1 mtp85 -106.34 105.46 15.5 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.1 m -119.15 144.0 46.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.067 0.461 . . . . 0.0 110.203 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.401 ' OD1' ' C ' ' A' ' 39' ' ' ASN . 13.6 p30 -124.3 160.1 28.78 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.452 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.1 p -120.28 120.69 63.63 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.253 0 CA-C-O 121.119 0.485 . . . . 0.0 110.202 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 66.7 m -95.9 116.96 29.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.152 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -139.34 137.36 35.71 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.97 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.497 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 43.1 t 48.04 32.3 2.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.814 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.86 33.52 57.5 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -137.87 122.86 19.03 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 18.7 p -105.02 109.56 21.61 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.05 -179.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -95.12 141.42 28.77 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.084 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.584 ' NE2' ' NH2' ' A' ' 37' ' ' ARG . 58.0 tt0 -148.31 144.51 27.63 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.856 0.36 . . . . 0.0 110.546 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.3 p -84.3 163.13 19.81 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.631 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.0 m -89.76 -7.34 54.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.648 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -112.28 148.94 33.11 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.128 0.49 . . . . 0.0 109.929 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.685 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -101.61 131.95 47.54 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.481 -179.615 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.503 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -86.43 148.29 46.45 Favored Pre-proline 0 C--N 1.307 -1.257 0 CA-C-N 114.076 -1.42 . . . . 0.0 111.131 -179.489 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -77.42 -8.38 17.25 Favored 'Trans proline' 0 N--CA 1.495 1.584 0 C-N-CA 122.674 2.25 . . . . 0.0 111.984 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 41.5 m -129.07 148.4 51.02 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.772 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.4 tt -63.83 -61.9 1.99 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.159 -178.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -54.49 -34.21 61.21 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 121.028 -0.269 . . . . 0.0 110.741 -178.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.5 t -55.89 -34.03 65.17 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.104 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.87 -41.98 67.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.158 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -63.99 -41.68 97.43 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.663 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -66.99 -47.76 70.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.811 0.339 . . . . 0.0 110.83 -179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.51 -38.29 84.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.606 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.8 -48.37 82.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.597 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.06 -36.81 80.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.366 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.0 -47.43 83.05 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 97.1 mt -59.69 -45.92 93.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.106 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.32 -43.29 86.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.087 0.47 . . . . 0.0 110.41 179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.1 t -59.56 -42.3 87.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.216 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.05 -27.45 69.11 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.969 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.4 t . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.557 -179.896 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 N--CA 1.455 -0.223 0 CA-C-O 120.58 0.229 . . . . 0.0 110.936 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.639 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 4.7 m-85 -58.14 -42.97 87.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.862 -178.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.529 ' NZ ' ' OE1' ' A' ' 60' ' ' GLU . 98.8 mttt -59.45 -40.37 86.62 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.213 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -69.99 -28.15 72.13 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.202 -0.759 . . . . 0.0 111.202 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -77.28 -50.68 12.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.103 0.478 . . . . 0.0 111.357 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 56.1 tp -62.38 -41.51 98.7 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.259 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -62.53 -39.62 94.16 Favored 'General case' 0 C--N 1.31 -1.134 0 C-N-CA 119.641 -0.824 . . . . 0.0 110.035 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.42 -39.39 77.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.82 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -61.78 -52.61 63.52 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.031 -179.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.87 -47.86 79.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.021 0.439 . . . . 0.0 110.304 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.8 tp -62.56 -44.41 96.39 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.593 -179.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -65.03 -40.89 95.49 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.597 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.525 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 64.8 t-80 -87.03 -2.8 58.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.77 -179.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 58.72 65.56 1.22 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.888 0.375 . . . . 0.0 110.185 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.8 mt -128.67 147.43 50.74 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.498 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -41.7 133.41 2.73 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.568 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.5 mt -48.13 144.39 5.99 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.96 -179.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -70.6 153.94 64.74 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.317 2.012 . . . . 0.0 111.952 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.5 t -131.43 130.54 62.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.636 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -105.22 153.11 22.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.447 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.528 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -119.57 140.81 49.96 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.371 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -118.05 126.69 52.77 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.787 0.327 . . . . 0.0 111.205 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -136.5 131.16 33.59 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 178.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.9 ttp85 . . . . . 0 CA--C 1.515 -0.381 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.649 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.609 ' NH1' ' CD1' ' A' ' 52' ' ' PHE . 96.5 mtt-85 . . . . . 0 CA--C 1.517 -0.295 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -114.36 103.96 11.59 Favored 'General case' 0 CA--C 1.508 -0.639 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.85 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -99.97 106.61 18.43 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.646 -0.422 . . . . 0.0 109.909 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.528 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 45.9 t -111.02 123.05 49.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.505 -179.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -106.47 150.55 25.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.002 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.5 p -119.76 119.74 61.23 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.201 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 96.5 m -93.96 122.12 36.14 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.375 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -143.0 131.99 22.94 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.473 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 49.9 t 46.14 46.7 13.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.933 0.397 . . . . 0.0 110.81 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.09 33.2 84.97 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.281 -0.727 . . . . 0.0 111.281 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.423 ' CG ' ' CE1' ' A' ' 47' ' ' PHE . 68.1 tp60 -139.28 125.17 19.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.826 0.346 . . . . 0.0 110.203 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.8 p -105.41 109.95 22.11 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.233 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.423 ' CE1' ' CG ' ' A' ' 45' ' ' GLN . 51.4 m-85 -90.77 140.88 29.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.165 -0.47 . . . . 0.0 109.782 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -148.51 149.4 31.58 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.175 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 42.5 t -88.69 162.12 16.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.642 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 96.4 p -87.67 -6.8 58.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.716 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -123.1 143.45 49.97 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.211 0.529 . . . . 0.0 110.781 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.609 ' CD1' ' NH1' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -91.7 142.62 27.41 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.891 -179.272 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.501 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -94.22 147.59 33.63 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 114.659 -1.155 . . . . 0.0 111.185 -179.568 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -76.15 -4.71 15.45 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 C-N-CA 122.69 2.26 . . . . 0.0 112.496 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.33 155.37 50.71 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.225 0.536 . . . . 0.0 111.132 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.03 -64.04 0.94 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.371 -178.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -54.64 -34.23 61.82 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 120.659 0.266 . . . . 0.0 110.575 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.6 t -55.79 -36.44 67.39 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.573 -0.451 . . . . 0.0 109.803 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.84 -41.19 71.79 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.5 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.529 ' OE1' ' NZ ' ' A' ' 6' ' ' LYS . 98.7 mt-10 -62.15 -43.06 99.68 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.874 -179.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.639 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -62.7 -51.38 67.41 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.208 0.528 . . . . 0.0 110.311 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.57 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -64.84 -35.24 80.47 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.176 -178.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.79 -49.39 77.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.594 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.7 -32.52 71.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.612 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -55.22 -45.75 75.96 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.619 0.247 . . . . 0.0 111.151 -179.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.3 pt -72.12 -37.45 59.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.62 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.85 -50.44 56.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.001 0.429 . . . . 0.0 111.961 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.96 -36.81 78.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.67 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.61 -26.96 68.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.755 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 37.5 m . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.936 179.743 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.1 m . . . . . 0 CA--C 1.522 -0.121 0 CA-C-O 120.618 0.247 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -60.13 -42.17 94.22 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.826 0.346 . . . . 0.0 110.867 -178.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.666 ' HZ2' ' CD2' ' A' ' 61' ' ' HIS . 64.3 mttp -60.87 -41.25 95.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.211 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.37 -31.62 81.47 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.736 -0.946 . . . . 0.0 110.736 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -75.94 -48.53 20.84 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.709 0.29 . . . . 0.0 111.459 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.2 tp -62.99 -39.42 94.66 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.305 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -63.06 -41.66 99.5 Favored 'General case' 0 N--CA 1.437 -1.105 0 C-N-CA 119.655 -0.818 . . . . 0.0 110.285 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.64 -40.25 84.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.895 179.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.42 ' O ' ' N ' ' A' ' 16' ' ' HIS . 53.8 t80 -61.98 -51.28 68.69 Favored 'General case' 0 N--CA 1.462 0.148 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.805 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.98 -40.4 73.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.433 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 39.1 tp -63.17 -46.21 88.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.529 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -79.61 -20.52 46.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.975 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.42 ' N ' ' O ' ' A' ' 12' ' ' TYR . 38.8 t-80 -87.15 -13.55 43.74 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.693 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 49.62 64.88 1.58 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.249 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -139.79 169.16 18.22 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.982 0.42 . . . . 0.0 110.452 179.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -46.36 126.08 7.54 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.739 178.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -45.81 151.42 0.85 Allowed Pre-proline 0 CA--C 1.539 0.542 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.669 -178.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.18 151.03 72.39 Favored 'Trans proline' 0 N--CA 1.499 1.802 0 C-N-CA 122.42 2.08 . . . . 0.0 112.215 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.4 t -133.51 131.08 57.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.227 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -106.14 152.13 23.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.885 179.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.485 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -114.56 146.01 41.27 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.1 178.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -124.42 124.56 42.6 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.788 0.328 . . . . 0.0 111.636 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -132.75 129.07 38.16 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 71.2 ttt-85 . . . . . 0 CA--C 1.516 -0.359 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.355 -179.528 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 . . . . . 0 N--CA 1.464 0.267 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -114.56 102.39 10.01 Favored 'General case' 0 CA--C 1.505 -0.787 0 C-N-CA 119.647 -0.821 . . . . 0.0 111.53 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.5 mtp85 -101.08 107.82 19.35 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.789 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.485 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 48.4 t -109.53 122.35 47.24 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.634 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.508 ' OD1' ' N ' ' A' ' 40' ' ' VAL . 40.8 t-20 -103.61 150.74 23.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.701 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.508 ' N ' ' OD1' ' A' ' 39' ' ' ASN . 4.0 p -122.42 119.6 58.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.866 0.365 . . . . 0.0 110.417 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 98.3 m -96.47 121.33 38.16 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.072 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -144.19 136.0 26.09 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.422 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 42.7 t 45.82 44.65 11.07 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.411 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.54 30.76 77.48 Favored Glycine 0 CA--C 1.526 0.776 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.921 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -135.48 131.06 35.64 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 122.691 -0.299 . . . . 0.0 110.314 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 54.4 p -108.8 107.4 17.81 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.047 0.451 . . . . 0.0 111.101 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -92.7 141.56 28.34 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.111 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -152.23 147.7 26.7 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.749 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.4 p -85.79 166.14 16.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.818 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 85.3 p -92.64 -6.96 48.28 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.626 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -122.7 129.51 51.89 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.006 0.432 . . . . 0.0 110.898 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -79.2 148.64 32.19 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.686 0.755 . . . . 0.0 110.17 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.485 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -96.22 150.33 37.05 Favored Pre-proline 0 C--N 1.313 -0.982 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.857 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -77.6 -4.41 14.57 Favored 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 122.421 2.081 . . . . 0.0 112.712 178.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.463 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -134.8 152.42 51.74 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 120.961 0.41 . . . . 0.0 110.851 -179.516 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.43 -62.44 1.53 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.762 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -56.11 -35.97 67.68 Favored 'General case' 0 CA--C 1.52 -0.198 0 O-C-N 122.137 -0.352 . . . . 0.0 110.816 -177.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.463 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 38.5 m -54.68 -36.12 64.3 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.1 -43.21 74.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.454 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.54 -41.86 97.97 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.463 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.666 ' CD2' ' HZ2' ' A' ' 6' ' ' LYS . 32.4 m170 -62.73 -48.81 77.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.766 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.05 -35.51 80.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.827 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.47 -48.88 79.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.478 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.86 -33.49 75.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -54.79 -46.91 74.51 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.656 0.265 . . . . 0.0 111.084 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.1 pt -73.97 -33.11 35.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.872 0.368 . . . . 0.0 110.663 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.443 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -67.33 -50.26 60.76 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.831 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.3 p -65.4 -30.11 49.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.527 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.41 -33.86 73.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.118 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.443 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 78.0 p . . . . . 0 C--N 1.331 -0.216 0 CA-C-O 121.019 0.438 . . . . 0.0 110.576 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.531 0.245 0 CA-C-O 120.966 0.412 . . . . 0.0 110.635 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.628 ' N ' ' CD1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -61.17 -23.83 65.85 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.859 -179.551 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -62.39 -42.39 99.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.154 0.502 . . . . 0.0 110.322 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.72 -23.55 76.44 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.086 -0.806 . . . . 0.0 111.086 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -78.04 -50.35 12.25 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.83 0.348 . . . . 0.0 111.179 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.5 tp -62.74 -42.59 99.74 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.14 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.9 tp-100 -64.45 -42.58 95.88 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.138 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.91 -37.27 78.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.824 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -61.52 -49.83 75.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.679 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.6 -47.3 84.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.934 0.397 . . . . 0.0 110.246 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.4 tp -62.15 -46.37 89.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.517 -179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -65.76 -38.7 89.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.976 0.417 . . . . 0.0 110.487 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.502 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 61.6 t-80 -87.51 -0.58 57.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.607 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 56.5 65.1 1.5 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.642 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 81.6 mt -127.71 151.7 48.65 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.678 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -46.86 128.0 10.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.131 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.441 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 10.0 mp -46.95 147.95 2.08 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.473 -178.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.06 152.57 62.7 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.369 2.046 . . . . 0.0 112.214 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 68.7 t -130.22 130.2 65.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.517 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -105.37 152.62 22.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.596 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.516 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -116.56 145.1 43.6 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.476 178.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -123.29 124.62 43.39 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.837 0.351 . . . . 0.0 111.234 -179.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -134.14 134.75 42.55 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.805 178.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 . . . . . 0 N--CA 1.465 0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.687 -179.36 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 . . . . . 0 CA--C 1.515 -0.402 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -114.86 104.35 11.85 Favored 'General case' 0 CA--C 1.506 -0.737 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.789 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -101.76 107.25 18.4 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.065 0.46 . . . . 0.0 110.599 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.516 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 50.9 t -109.55 124.25 50.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.967 -179.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -105.24 149.95 25.55 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.3 p -119.7 119.32 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 120.913 0.387 . . . . 0.0 110.025 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 96.4 m -95.67 121.93 37.9 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.12 179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.482 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 5.3 t80 -143.07 137.38 29.15 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.36 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.483 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 12.0 p 42.19 42.83 2.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.829 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . 0.484 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 66.16 32.35 82.01 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.436 -0.666 . . . . 0.0 111.436 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.484 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 97.7 mm-40 -136.46 130.87 33.25 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.66 0.266 . . . . 0.0 110.357 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 61.8 p -110.04 107.59 17.51 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.221 -179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.526 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 52.3 m-85 -94.14 141.06 28.97 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.966 179.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -154.26 148.03 25.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.481 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.6 p -85.31 168.21 14.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.464 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.9 p -93.83 -0.61 55.71 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.544 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -120.88 153.28 37.38 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.044 0.449 . . . . 0.0 110.344 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.686 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -103.94 134.69 46.81 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.813 -179.488 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.49 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -86.27 147.99 46.17 Favored Pre-proline 0 C--N 1.306 -1.318 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.579 -179.695 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.41 -4.63 15.28 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.704 2.269 . . . . 0.0 112.433 179.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -136.09 154.73 50.92 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.079 0.466 . . . . 0.0 111.22 -179.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.17 -62.62 1.43 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.312 -178.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.41 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 98.8 mttt -55.39 -34.46 64.37 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.756 0.312 . . . . 0.0 110.658 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 39.4 m -54.48 -35.94 63.61 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.454 -0.498 . . . . 0.0 109.925 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.17 -43.71 64.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.408 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -63.76 -44.27 93.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.645 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.41 ' CD2' ' O ' ' A' ' 57' ' ' LYS . 89.3 m-70 -64.04 -49.19 73.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.627 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.93 -35.2 79.96 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.611 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.15 -41.43 83.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.261 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.28 -34.59 78.34 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.625 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -53.87 -47.58 70.91 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.508 0.194 . . . . 0.0 110.907 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.8 pt -74.35 -27.93 22.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.583 179.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.58 -51.15 30.3 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.914 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.0 p -63.27 -30.67 50.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.425 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.9 -35.1 76.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.862 0.363 . . . . 0.0 110.794 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.526 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 17.7 m . . . . . 0 C--N 1.331 -0.232 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.668 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 33.2 m . . . . . 0 N--CA 1.452 -0.371 0 CA-C-O 120.593 0.235 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.667 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 3.2 m-85 -59.31 -44.21 92.58 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.759 -178.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -58.45 -43.53 88.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.413 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -72.79 -24.38 76.18 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 69.7 tp60 -77.13 -48.77 16.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.946 0.403 . . . . 0.0 111.087 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.8 tp -61.75 -41.45 97.7 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.291 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -62.85 -40.82 98.64 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.743 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.98 -38.18 79.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.553 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 86.0 t80 -62.0 -51.75 66.78 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.665 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.511 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -58.19 -46.22 86.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.416 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.6 tp -62.26 -47.2 85.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.729 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -66.19 -36.44 83.1 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.627 -179.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 61.8 m80 -92.05 -3.2 56.09 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.711 -179.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.511 ' N ' ' O ' ' A' ' 13' ' ' ALA . 97.4 m-20 56.76 66.01 1.27 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.698 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 70.1 mt -125.31 145.39 50.04 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.988 0.423 . . . . 0.0 110.48 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.585 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 1.3 pm0 -41.04 134.96 1.89 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.183 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.8 mt -47.31 143.37 5.17 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.973 -179.006 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -73.06 153.41 52.07 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 122.37 2.047 . . . . 0.0 111.989 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.4 t -129.65 130.62 66.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.413 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -107.02 153.01 23.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.718 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.515 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -115.47 146.39 41.7 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.326 178.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -123.97 124.16 41.98 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.062 0.458 . . . . 0.0 111.357 -179.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -134.86 129.34 34.27 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.0 ttt-85 . . . . . 0 CA--C 1.519 -0.248 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.532 -179.419 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 84.8 mtm-85 . . . . . 0 CA--C 1.516 -0.336 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -114.23 104.05 11.7 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.949 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -102.87 105.84 16.3 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.515 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 52.6 t -109.21 124.55 51.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.398 -179.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -105.43 150.02 25.64 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.919 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.1 p -120.9 119.69 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 CA-C-O 121.036 0.446 . . . . 0.0 110.243 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 96.4 m -97.23 120.48 37.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.506 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.556 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 5.1 t80 -141.68 137.8 32.01 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.266 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.556 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 3.9 m 45.32 37.32 2.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.716 179.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . 0.471 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 69.68 32.62 70.84 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 111.25 -0.74 . . . . 0.0 111.25 179.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.471 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 98.0 mm-40 -135.99 125.11 24.44 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 39.9 p -105.78 107.33 18.27 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.105 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -92.5 141.07 28.92 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.019 179.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 55.1 tt0 -150.49 152.3 34.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.325 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 73.2 m -95.42 160.56 14.47 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.532 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.8 m -87.2 -7.1 58.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.713 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.537 ' N ' ' OE1' ' A' ' 51' ' ' GLU . 56.3 mp0 -115.26 151.86 33.75 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.271 0.558 . . . . 0.0 110.237 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.691 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -103.53 133.7 48.12 Favored 'General case' 0 CA--C 1.505 -0.75 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.01 -179.219 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.46 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -86.19 147.16 44.28 Favored Pre-proline 0 C--N 1.308 -1.236 0 CA-C-N 114.118 -1.401 . . . . 0.0 110.831 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.84 -5.13 16.08 Favored 'Trans proline' 0 N--CA 1.498 1.756 0 C-N-CA 122.792 2.328 . . . . 0.0 112.581 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.471 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -135.07 155.42 50.77 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.141 0.496 . . . . 0.0 111.002 -179.379 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.68 -64.68 0.81 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.569 -178.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -53.11 -33.45 52.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.894 0.378 . . . . 0.0 110.657 -178.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.471 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 33.2 m -57.26 -35.05 69.26 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.047 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.3 -41.22 70.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.27 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -62.31 -40.25 95.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.38 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.667 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -64.66 -51.17 63.95 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.204 0.526 . . . . 0.0 110.501 179.74 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.549 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -65.71 -35.73 81.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.595 -178.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.91 -48.91 79.78 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.492 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.36 -32.91 73.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.733 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -54.93 -45.86 74.88 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.851 0.357 . . . . 0.0 111.34 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.2 pt -73.74 -33.51 38.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.986 0.422 . . . . 0.0 110.548 179.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.83 -50.0 47.02 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.125 0.488 . . . . 0.0 111.64 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.2 p -64.56 -31.11 52.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.407 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.51 -30.2 68.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.722 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.1 t . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.805 179.823 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.4 m . . . . . 0 N--CA 1.452 -0.361 0 CA-C-O 120.619 0.247 . . . . 0.0 110.399 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -58.45 -44.15 89.12 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 120.805 0.336 . . . . 0.0 110.722 -179.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -58.98 -37.05 75.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.527 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.52 -26.26 59.47 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.1 mm-40 -78.66 -50.77 10.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.985 0.421 . . . . 0.0 111.091 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 35.7 tp -61.44 -42.78 99.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.582 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -63.15 -40.67 98.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.814 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.86 -37.35 79.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.385 179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -61.74 -50.01 74.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.769 -179.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.467 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.91 -47.71 79.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.942 0.401 . . . . 0.0 110.584 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.3 tp -61.6 -45.4 94.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.548 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -66.2 -41.81 89.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.649 -179.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.474 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 66.3 t-80 -86.52 -5.05 59.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.565 -179.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.467 ' N ' ' O ' ' A' ' 13' ' ' ALA . 44.4 t-20 60.49 65.83 1.01 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.584 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.7 mt -125.34 147.83 48.98 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.868 0.366 . . . . 0.0 110.393 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -45.41 134.37 6.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.033 0.444 . . . . 0.0 110.272 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.5 mt -46.06 143.85 3.27 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.739 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -73.0 155.44 52.8 Favored 'Trans proline' 0 C--N 1.309 -1.531 0 C-N-CA 122.733 2.289 . . . . 0.0 112.086 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.4 t -129.53 132.38 66.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.466 179.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -108.88 153.59 23.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.692 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.513 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -116.19 141.17 48.49 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.823 178.322 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -119.76 125.53 48.84 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.026 0.441 . . . . 0.0 110.966 -179.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -135.09 125.86 27.26 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.769 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 . . . . . 0 C--O 1.233 0.215 0 CA-C-O 120.954 0.407 . . . . 0.0 110.388 -179.457 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 . . . . . 0 CA--C 1.516 -0.362 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -114.11 103.89 11.57 Favored 'General case' 0 C--O 1.216 -0.706 0 C-N-CA 120.338 -0.545 . . . . 0.0 111.162 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.658 HH21 ' NE2' ' A' ' 48' ' ' GLN . 79.5 mtp85 -104.94 104.95 14.8 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 53.7 t -110.08 128.3 55.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.42 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -108.29 152.36 24.73 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.128 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 p -121.06 120.46 62.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.074 0.464 . . . . 0.0 110.285 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 54.1 m -98.85 119.31 37.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.554 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -143.05 136.24 28.17 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.369 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.47 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 42.6 t 52.21 33.63 12.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.607 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 70.33 33.9 68.66 Favored Glycine 0 CA--C 1.522 0.488 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -139.09 125.4 20.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.836 0.35 . . . . 0.0 110.338 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 33.1 m -105.48 109.79 21.89 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.046 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -95.54 141.15 29.4 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.847 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.658 ' NE2' HH21 ' A' ' 37' ' ' ARG . 58.9 tt0 -144.58 147.96 33.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.933 0.397 . . . . 0.0 110.42 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.423 ' OG ' ' O ' ' A' ' 51' ' ' GLU . 9.3 p -84.63 161.83 19.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.523 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 91.5 p -88.61 -6.75 57.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.554 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.423 ' O ' ' OG ' ' A' ' 49' ' ' SER . 98.8 mt-10 -122.5 157.05 32.85 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.083 0.468 . . . . 0.0 110.355 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.69 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -105.01 139.22 40.02 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.613 0.721 . . . . 0.0 110.036 -179.271 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.466 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -91.4 147.77 36.12 Favored Pre-proline 0 C--N 1.308 -1.198 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.75 -179.668 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.81 -5.3 16.27 Favored 'Trans proline' 0 C--N 1.312 -1.388 0 C-N-CA 122.838 2.359 . . . . 0.0 112.4 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.433 ' O ' ' OG ' ' A' ' 58' ' ' SER . 44.1 m -132.61 155.78 48.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.266 0.555 . . . . 0.0 110.729 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.403 ' N ' ' CG2' ' A' ' 55' ' ' THR . 0.9 OUTLIER -69.86 -64.92 0.79 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.122 -178.676 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -52.02 -37.26 52.78 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.587 -177.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.433 ' OG ' ' O ' ' A' ' 55' ' ' THR . 78.0 p -55.0 -33.08 62.29 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 123.429 0.455 . . . . 0.0 110.382 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.47 -40.9 66.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.823 0.344 . . . . 0.0 110.925 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -64.47 -40.4 95.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.383 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -68.17 -46.08 71.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.752 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.92 -39.64 83.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.848 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.19 -48.95 79.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.728 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.32 -36.79 78.73 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.404 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -58.06 -47.7 82.36 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.433 HG21 HD13 ' A' ' 66' ' ' ILE . 86.3 mt -58.15 -47.32 87.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.318 -179.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.76 -44.94 76.31 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.587 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.5 t -58.54 -42.5 84.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.048 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.99 -25.97 68.37 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.539 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 6.3 t . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.633 -179.971 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.6 m . . . . . 0 N--CA 1.453 -0.283 0 CA-C-O 120.489 0.185 . . . . 0.0 110.895 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.655 ' CE2' ' ND1' ' A' ' 61' ' ' HIS . 17.6 m-85 -43.12 -64.79 0.57 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.88 0.371 . . . . 0.0 111.243 -179.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -50.83 -36.57 38.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.577 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -66.62 -36.69 91.72 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.916 -0.873 . . . . 0.0 110.916 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.8 tp60 -77.85 -49.2 14.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.988 0.423 . . . . 0.0 111.241 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 39.1 tp -60.06 -41.96 93.46 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.189 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -63.82 -41.93 97.76 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.912 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.45 -37.3 77.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.635 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.622 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 92.0 t80 -61.36 -53.56 55.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.982 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.436 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.47 -50.53 71.48 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.115 0.483 . . . . 0.0 110.653 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.52 -43.52 98.62 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.137 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -65.32 -39.26 92.21 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.584 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.622 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 60.3 m80 -89.72 -4.63 57.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.548 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.436 ' N ' ' O ' ' A' ' 13' ' ' ALA . 62.8 t30 62.36 67.13 0.74 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.521 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.3 mt -129.17 147.65 51.04 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 120.872 0.368 . . . . 0.0 110.642 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -44.18 137.52 3.41 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.192 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.9 mt -50.23 144.1 11.93 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.073 -179.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -70.64 151.53 64.13 Favored 'Trans proline' 0 C--N 1.312 -1.344 0 C-N-CA 122.322 2.015 . . . . 0.0 111.881 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 68.1 t -127.7 130.47 70.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.118 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -105.28 153.18 21.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.67 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.496 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -118.0 143.86 46.04 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.416 178.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -120.48 127.35 52.14 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.832 0.349 . . . . 0.0 111.207 -179.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -137.85 130.49 29.67 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.794 178.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 . . . . . 0 CA--C 1.517 -0.309 0 CA-C-O 120.811 0.338 . . . . 0.0 110.452 -179.523 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 . . . . . 0 CA--C 1.513 -0.469 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -114.07 103.4 11.09 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.167 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 90.9 mtm180 -99.73 106.48 18.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.15 0.5 . . . . 0.0 109.867 -179.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.496 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 45.0 t -110.63 122.29 47.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.358 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -105.24 152.78 22.45 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.839 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.0 p -121.48 120.1 60.89 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.282 0 CA-C-O 121.111 0.482 . . . . 0.0 110.246 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 94.8 m -95.18 121.69 37.08 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.107 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.422 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.1 t80 -140.73 136.25 32.36 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.803 0.335 . . . . 0.0 110.441 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 14.2 m 43.94 32.06 0.58 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.896 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.02 33.82 44.19 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.422 ' N ' ' O ' ' A' ' 42' ' ' PHE . 86.5 mt-30 -136.69 122.97 20.56 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 29.8 p -103.32 108.23 19.38 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.895 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -90.97 140.28 29.98 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.768 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -143.12 144.64 32.3 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.426 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.721 ' HG ' ' H ' ' A' ' 51' ' ' GLU . 39.3 t -87.4 159.97 18.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.493 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 86.4 p -89.7 -5.82 56.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.682 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.721 ' H ' ' HG ' ' A' ' 49' ' ' SER . 97.4 mt-10 -117.81 153.26 33.78 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.18 0.514 . . . . 0.0 110.052 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.67 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -103.46 133.21 48.89 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-O 121.856 0.836 . . . . 0.0 109.917 -179.289 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.428 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -87.64 145.93 38.18 Favored Pre-proline 0 C--N 1.311 -1.099 0 CA-C-N 114.045 -1.434 . . . . 0.0 110.748 179.879 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -76.38 -5.46 16.18 Favored 'Trans proline' 0 N--CA 1.496 1.623 0 C-N-CA 122.735 2.29 . . . . 0.0 112.433 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.48 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 1.1 p -136.21 155.89 49.47 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.027 0.441 . . . . 0.0 110.9 -179.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.15 -64.18 0.91 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.108 -178.656 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -52.7 -34.16 50.88 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.536 -177.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.48 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 21.6 m -56.48 -36.02 68.64 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.274 179.416 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.42 -38.4 71.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.03 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.33 -43.94 96.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.526 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.655 ' ND1' ' CE2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -61.71 -50.23 73.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.171 0.51 . . . . 0.0 110.588 179.826 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.58 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -66.82 -36.06 81.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.632 -179.134 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.72 -47.95 82.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.685 -179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.39 -32.51 72.62 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.594 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -58.79 -53.89 53.3 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.07 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.6 pt -58.6 -44.6 89.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.44 -179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.7 -45.03 76.3 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.984 0.421 . . . . 0.0 110.402 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.1 t -60.35 -42.56 91.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.65 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.08 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.2 -27.45 68.99 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.458 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.514 179.646 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.8 m . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 120.7 0.286 . . . . 0.0 110.709 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -60.66 -40.97 94.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.878 0.37 . . . . 0.0 110.607 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -58.74 -40.5 84.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.544 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -70.77 -25.44 75.72 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 96.4 mm-40 -77.35 -48.62 16.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.193 0.52 . . . . 0.0 111.297 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 44.7 tp -62.55 -42.08 99.31 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.367 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -64.07 -42.25 97.06 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.724 -179.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.03 -36.82 78.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.374 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.605 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 91.2 t80 -61.73 -51.07 69.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.794 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.506 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -57.58 -48.02 80.53 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.01 0.433 . . . . 0.0 110.369 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.1 tp -62.74 -44.77 95.34 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.529 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -64.98 -38.97 92.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.689 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.605 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 64.6 m80 -93.09 -1.23 56.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.614 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.506 ' N ' ' O ' ' A' ' 13' ' ' ALA . 11.9 m120 55.92 65.29 1.48 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.532 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.2 mt -122.02 149.49 43.43 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.03 0.443 . . . . 0.0 110.326 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.437 ' OE1' ' N ' ' A' ' 19' ' ' GLU . 55.6 mp0 -41.3 151.54 0.07 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.579 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.475 ' CD2' ' N ' ' A' ' 20' ' ' LEU . 3.5 mm? -61.54 137.74 94.86 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.914 -178.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.28 154.54 56.46 Favored 'Trans proline' 0 C--N 1.317 -1.101 0 C-N-CA 122.069 1.846 . . . . 0.0 112.004 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 68.6 t -133.17 134.87 57.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.537 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -111.88 152.1 28.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.898 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -109.84 144.78 37.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.079 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -127.08 120.34 28.72 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.915 0.388 . . . . 0.0 111.354 -179.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -133.45 127.66 33.8 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 . . . . . 0 CA--C 1.515 -0.384 0 CA-C-O 120.719 0.295 . . . . 0.0 110.378 -179.472 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 87.9 mtm-85 . . . . . 0 CA--C 1.512 -0.5 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -114.51 103.83 11.42 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 120.146 -0.622 . . . . 0.0 110.977 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.494 HH12 ' C ' ' A' ' 50' ' ' SER . 33.7 mmt180 -104.38 105.29 15.36 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.29 0.566 . . . . 0.0 110.03 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 74.1 m -114.23 134.18 55.1 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.309 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.43 ' OD1' ' OE1' ' A' ' 48' ' ' GLN . 59.6 m-20 -110.14 157.89 18.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.353 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 p -122.42 120.75 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-O 121.202 0.525 . . . . 0.0 110.108 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 52.0 m -102.73 119.86 39.57 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.439 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.516 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.4 t80 -143.91 138.54 28.62 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.183 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.451 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 48.7 t 42.62 32.77 0.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.811 0.338 . . . . 0.0 110.909 179.774 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.27 30.27 59.0 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.516 ' N ' ' O ' ' A' ' 42' ' ' PHE . 99.1 mm-40 -125.19 119.23 27.95 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.817 0.342 . . . . 0.0 110.245 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 26.3 p -109.78 100.73 9.69 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.555 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -107.85 143.24 36.72 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.417 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.43 ' OE1' ' OD1' ' A' ' 39' ' ' ASN . 18.0 pt20 -153.52 154.04 33.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.772 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.3 p -82.35 162.21 22.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.403 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.494 ' C ' HH12 ' A' ' 37' ' ' ARG . 91.2 p -92.11 -3.11 56.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.577 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -109.77 153.28 24.57 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.239 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.629 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 1.0 OUTLIER -102.23 122.85 45.0 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 121.735 0.779 . . . . 0.0 109.923 -179.228 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.488 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.6 OUTLIER -78.34 148.98 75.05 Favored Pre-proline 0 C--N 1.306 -1.303 0 CA-C-N 114.144 -1.389 . . . . 0.0 110.748 -179.847 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -77.72 -6.48 16.12 Favored 'Trans proline' 0 N--CA 1.493 1.466 0 C-N-CA 122.628 2.218 . . . . 0.0 112.35 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.458 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -136.11 153.52 51.28 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.981 0.42 . . . . 0.0 110.384 -179.308 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.64 -60.32 3.48 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.007 -179.231 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -55.02 -34.09 63.19 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.927 -177.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.458 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 37.9 m -57.13 -35.88 70.01 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.206 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.53 -47.81 52.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.813 0.339 . . . . 0.0 111.283 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -62.56 -42.1 99.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.356 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -66.32 -45.74 79.27 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.683 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.45 -38.35 84.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.714 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.72 -48.0 82.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.552 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.4 -38.69 77.86 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.402 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -55.12 -43.21 73.88 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.007 0.432 . . . . 0.0 110.107 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 62.4 mt -68.13 -42.95 85.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.439 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.437 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -65.48 -49.31 69.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.032 0.444 . . . . 0.0 111.657 -178.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.8 p -67.25 -29.02 44.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.369 -179.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.8 -27.42 62.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.825 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 83.6 p . . . . . 0 C--N 1.331 -0.231 0 CA-C-O 121.051 0.453 . . . . 0.0 110.522 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 15.3 m . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.733 0.301 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.659 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 4.3 m-85 -61.27 -42.54 98.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.738 -179.221 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -59.35 -42.66 92.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.372 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.44 -24.29 63.43 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 111.229 -0.748 . . . . 0.0 111.229 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -76.92 -48.61 17.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.0 0.428 . . . . 0.0 110.938 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 33.6 tp -62.95 -41.52 99.53 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.09 -179.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -62.01 -41.75 98.4 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 119.701 -0.8 . . . . 0.0 110.614 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.61 -36.4 80.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.631 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.621 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 76.2 t80 -61.25 -51.18 70.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.596 -179.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.76 -48.96 76.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.084 0.468 . . . . 0.0 110.23 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.1 tp -62.68 -43.81 97.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.462 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -64.0 -40.31 96.08 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.626 -179.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 62.8 m80 -90.56 -4.94 56.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.63 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.476 ' N ' ' O ' ' A' ' 13' ' ' ALA . 63.3 t30 62.98 66.62 0.73 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.611 179.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.7 mt -127.67 148.3 50.39 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.457 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -45.78 136.94 5.8 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.932 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.0 mt -47.31 143.89 4.81 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.993 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -72.66 155.92 53.91 Favored 'Trans proline' 0 N--CA 1.494 1.509 0 C-N-CA 122.465 2.11 . . . . 0.0 112.016 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 74.9 t -129.58 130.34 67.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.445 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -106.55 152.4 23.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.333 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.506 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -113.68 145.86 40.69 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.388 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -125.02 121.96 35.89 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.742 0.306 . . . . 0.0 111.146 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -131.77 129.4 40.52 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 177.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.6 ttt-85 . . . . . 0 CA--C 1.516 -0.356 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.484 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 . . . . . 0 CA--C 1.516 -0.337 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -114.89 104.15 11.64 Favored 'General case' 0 CA--C 1.508 -0.642 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.187 179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.8 mtp180 -100.52 105.94 17.43 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.674 -0.41 . . . . 0.0 109.9 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.506 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 44.1 t -110.63 125.26 53.24 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 120.96 0.41 . . . . 0.0 110.37 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -108.02 155.62 20.15 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.152 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.3 p -123.27 120.04 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.086 0.47 . . . . 0.0 110.347 -179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 95.4 m -97.92 119.27 36.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.233 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.524 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 5.3 t80 -140.07 139.44 35.9 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.337 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.524 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 6.2 m 44.11 32.25 0.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.6 32.32 54.67 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.496 -0.642 . . . . 0.0 111.496 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 42' ' ' PHE . 84.7 mt-30 -134.75 120.69 19.74 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.766 0.317 . . . . 0.0 110.253 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.2 m -102.72 107.68 18.65 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 121.02 0.438 . . . . 0.0 110.885 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -91.16 141.12 29.15 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.157 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -142.71 139.11 30.99 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.522 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.9 p -81.77 162.69 22.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.436 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.9 m -90.63 -9.24 47.69 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.732 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -120.99 142.37 49.85 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.266 0.555 . . . . 0.0 110.602 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.573 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.0 140.19 29.9 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.956 -179.368 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.411 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -92.33 147.93 35.49 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 114.711 -1.131 . . . . 0.0 111.12 -179.701 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -77.03 -4.61 15.07 Favored 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 122.807 2.338 . . . . 0.0 112.582 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.02 154.29 51.24 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.243 0.544 . . . . 0.0 111.143 -179.194 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.67 -64.86 0.78 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.632 -178.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -56.1 -35.45 67.04 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 120.731 0.301 . . . . 0.0 110.567 -177.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 40.2 t -56.45 -34.19 66.62 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.986 179.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.88 -39.46 79.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.27 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -62.43 -41.73 98.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.6 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.659 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -62.01 -52.17 65.06 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.162 0.506 . . . . 0.0 110.446 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.567 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -64.97 -37.24 86.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.743 -178.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.59 -45.46 91.81 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.437 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.16 -34.09 75.67 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.906 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -59.35 -52.8 64.08 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 121.092 -0.243 . . . . 0.0 111.421 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.4 pt -57.82 -45.57 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.124 -179.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.88 -43.36 83.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.083 0.468 . . . . 0.0 110.659 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.4 t -60.6 -42.71 92.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.064 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.67 -27.72 69.42 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.696 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.4 m . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.818 -179.946 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.8 m . . . . . 0 N--CA 1.456 -0.148 0 CA-C-O 121.013 0.435 . . . . 0.0 110.738 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -60.91 -44.52 97.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.653 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -59.83 -42.55 93.8 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.598 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.47 -34.92 91.2 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -74.99 -44.51 47.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.063 0.459 . . . . 0.0 111.053 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 49.1 tp -62.97 -40.79 98.78 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.199 -179.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -66.29 -40.06 89.8 Favored 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 119.901 -0.72 . . . . 0.0 110.785 -179.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.28 -40.15 89.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.449 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -62.91 -48.18 80.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.67 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.71 -40.27 62.84 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.381 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.413 ' O ' ' ND2' ' A' ' 17' ' ' ASN . 49.3 tp -63.49 -44.84 93.2 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.429 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.6 tp60 -70.29 -41.01 73.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.989 0.424 . . . . 0.0 111.122 -178.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.463 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 58.7 t-80 -74.0 -14.0 60.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.608 -179.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.413 ' ND2' ' O ' ' A' ' 14' ' ' LEU . 20.8 m120 54.83 69.0 0.78 Allowed 'General case' 0 C--O 1.233 0.198 0 C-N-CA 120.886 -0.325 . . . . 0.0 111.762 178.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -147.07 169.45 19.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.316 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -43.37 131.37 4.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.183 178.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.9 mp -53.94 152.35 10.54 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.717 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -66.82 148.61 82.77 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 C-N-CA 122.447 2.098 . . . . 0.0 112.085 179.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 75.0 t -132.84 132.2 59.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.561 179.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -107.99 151.32 25.98 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.468 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -126.16 131.96 51.92 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -112.65 137.61 50.67 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.854 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -139.84 150.39 44.61 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.6 ttt-85 . . . . . 0 CA--C 1.515 -0.366 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 -179.803 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 . . . . . 0 CA--C 1.516 -0.343 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -112.49 105.17 13.34 Favored 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 120.565 -0.454 . . . . 0.0 111.648 -178.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 -101.4 108.65 20.31 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.406 ' C ' HD21 ' A' ' 39' ' ' ASN . 62.0 m -115.01 143.67 44.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.921 0.391 . . . . 0.0 110.633 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.527 ' OD1' ' NE2' ' A' ' 48' ' ' GLN . 3.0 m120 -116.36 157.52 24.91 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.949 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.7 p -124.31 121.06 60.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.928 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 64.7 m -96.37 124.67 40.45 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.622 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.478 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.1 t80 -146.35 139.64 25.8 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.238 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.495 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 42.9 t 42.99 32.79 0.45 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.915 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 74.98 28.06 63.26 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 42' ' ' PHE . 87.0 mt-30 -131.32 130.85 43.27 Favored 'General case' 0 C--O 1.233 0.211 0 O-C-N 122.724 -0.28 . . . . 0.0 110.42 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 63.6 p -108.76 104.63 13.95 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.968 0.414 . . . . 0.0 110.879 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -89.83 140.68 29.37 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.964 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.527 ' NE2' ' OD1' ' A' ' 39' ' ' ASN . 87.8 mt-30 -141.01 154.77 46.16 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.313 -179.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 42.8 m -100.45 157.78 16.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.52 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.9 t -89.53 -2.6 58.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.718 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -116.85 136.34 53.03 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.268 0.556 . . . . 0.0 110.308 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.579 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.68 144.95 24.81 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.71 -179.578 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.55 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -105.97 148.05 35.86 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 114.623 -1.171 . . . . 0.0 111.085 179.783 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.87 -3.54 13.61 Favored 'Trans proline' 0 N--CA 1.5 1.891 0 C-N-CA 122.938 2.425 . . . . 0.0 112.64 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 89.3 m -134.88 154.24 51.74 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.04 0.447 . . . . 0.0 111.24 -179.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.19 -62.98 1.22 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.506 -178.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.473 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 98.5 mttt -54.1 -33.57 58.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.738 0.304 . . . . 0.0 110.593 -177.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.5 m -56.95 -34.71 68.29 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.434 -0.507 . . . . 0.0 110.032 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -73.1 -44.28 60.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.45 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.25 -41.92 94.23 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.741 -179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.476 ' ND1' ' N ' ' A' ' 61' ' ' HIS . 0.3 OUTLIER -61.81 -49.67 75.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.662 -179.727 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.51 -33.75 74.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.84 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.13 -49.19 77.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.825 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.67 -31.29 70.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.625 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -54.68 -46.21 74.03 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 121.124 -0.23 . . . . 0.0 110.75 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 23.3 pt -74.92 -30.88 24.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.817 0.341 . . . . 0.0 110.654 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.436 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -70.94 -52.07 22.08 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.125 0.488 . . . . 0.0 111.672 -179.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.1 p -61.71 -31.02 49.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.355 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.04 -28.64 64.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.731 179.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.436 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 78.0 p . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.734 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.0 m . . . . . 0 N--CA 1.453 -0.316 0 CA-C-O 120.58 0.228 . . . . 0.0 110.742 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -56.22 -45.76 79.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.848 0.356 . . . . 0.0 111.067 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -59.99 -41.57 92.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.579 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.84 -30.79 72.49 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.48 -0.648 . . . . 0.0 111.48 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 -76.81 -48.91 17.12 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.213 0.53 . . . . 0.0 110.631 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.2 tp -61.97 -42.59 99.31 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.507 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.2 tp60 -65.29 -40.93 94.46 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.531 -179.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.76 -39.29 76.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.807 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.467 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 90.3 t80 -61.86 -49.93 74.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.151 -179.376 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.89 -52.25 64.73 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.19 0.519 . . . . 0.0 110.592 -179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.68 -42.93 97.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.828 -179.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -53.71 -39.42 65.2 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.67 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.467 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 77.7 m80 -97.79 2.75 49.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.587 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 62.3 t30 64.54 67.37 0.57 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.022 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.5 mp -115.21 -172.97 2.23 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.545 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -91.77 139.77 30.35 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.941 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.445 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 10.2 mp -47.53 141.9 6.7 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.03 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.98 158.19 42.42 Favored 'Trans proline' 0 N--CA 1.495 1.578 0 C-N-CA 122.87 2.38 . . . . 0.0 111.824 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.6 t -129.96 134.65 62.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.547 179.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -114.24 154.64 27.57 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.238 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -118.67 144.51 46.15 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.0 178.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -123.86 125.38 44.56 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.254 0.55 . . . . 0.0 111.162 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -134.39 127.75 32.23 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 . . . . . 0 CA--C 1.516 -0.336 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.187 -179.455 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 . . . . . 0 CA--C 1.512 -0.515 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -113.86 104.16 11.91 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.756 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -103.58 105.82 16.16 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.108 0.48 . . . . 0.0 109.978 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 69.4 m -115.28 133.39 56.08 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.119 0.485 . . . . 0.0 111.26 -179.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.415 ' OD1' ' NE2' ' A' ' 48' ' ' GLN . 97.7 m-20 -110.27 153.36 24.95 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.522 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.2 p -120.48 119.83 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.316 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.6 m -97.32 119.64 36.21 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.377 179.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -143.18 139.63 30.41 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.462 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.423 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 49.5 t 47.98 32.28 2.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.842 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.99 31.38 61.98 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -137.43 132.68 33.76 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 40.9 p -108.71 107.01 17.3 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.032 -179.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -93.1 140.88 29.03 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.885 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.415 ' NE2' ' OD1' ' A' ' 39' ' ' ASN . 57.2 tt0 -151.5 146.9 26.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.337 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.0 p -85.57 164.31 17.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.695 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.0 p -90.24 -2.02 57.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.833 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -124.45 143.19 50.77 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.407 0.623 . . . . 0.0 110.808 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.644 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -91.45 143.14 26.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.54 -179.33 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.513 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -96.2 149.29 35.73 Favored Pre-proline 0 C--N 1.318 -0.8 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.132 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -77.23 -3.59 13.86 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 123.182 2.588 . . . . 0.0 112.752 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.443 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 0.8 OUTLIER -134.31 155.9 49.41 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.238 0.542 . . . . 0.0 110.757 -179.508 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.4 -66.01 0.65 Allowed 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.493 -178.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -53.22 -34.19 56.01 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.603 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.443 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 77.4 p -57.63 -33.27 68.09 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.579 179.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.11 -40.87 71.22 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.941 0.401 . . . . 0.0 110.888 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -65.37 -40.32 93.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.402 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 27.7 m170 -62.98 -50.31 71.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.749 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.25 -34.46 78.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.761 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.32 -46.35 86.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.598 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.77 -33.67 75.29 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.823 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 53.9 tttp -54.11 -46.03 72.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.587 0.232 . . . . 0.0 110.845 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.2 pt -74.84 -29.55 22.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.679 179.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.89 -51.49 25.88 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.471 -179.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.0 p -63.36 -29.01 46.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.281 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.82 -31.22 67.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 0.0 110.68 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 37.1 t . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.675 179.928 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 31.3 m . . . . . 0 N--CA 1.454 -0.268 0 CA-C-O 120.863 0.363 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.523 ' CE1' ' NE2' ' A' ' 61' ' ' HIS . 4.4 m-85 -53.58 -45.02 69.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.792 -179.103 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -62.12 -41.09 97.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.637 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.48 -30.36 56.7 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.249 -0.741 . . . . 0.0 111.249 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -75.63 -47.32 26.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.808 0.337 . . . . 0.0 111.106 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 35.0 tp -61.56 -43.13 99.43 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.385 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -64.25 -41.52 96.92 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.836 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.06 -36.96 78.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.584 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.631 ' CE2' ' CE1' ' A' ' 16' ' ' HIS . 50.0 t80 -59.73 -50.69 72.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.823 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.4 -48.34 77.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.489 179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 47.7 tp -62.02 -43.71 98.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.611 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -63.69 -39.3 93.98 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.712 -179.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.631 ' CE1' ' CE2' ' A' ' 12' ' ' TYR . 57.8 m80 -89.36 2.48 54.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.549 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 61.6 t30 60.0 61.66 1.83 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.526 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.8 mt -131.2 148.52 52.71 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.599 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -48.29 134.67 14.48 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.016 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.449 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 10.1 mp -48.51 150.02 2.6 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.858 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.92 152.57 63.43 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 C-N-CA 122.587 2.191 . . . . 0.0 111.934 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 79.6 t -129.2 128.76 67.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.415 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -104.82 152.49 22.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.402 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.532 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -126.0 132.68 51.97 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.207 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.482 ' ND2' ' SG ' ' A' ' 38' ' ' CYS . 8.3 m120 -110.39 136.44 49.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.956 0.407 . . . . 0.0 110.882 -178.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -139.74 149.69 43.91 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.022 179.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 . . . . . 0 C--O 1.232 0.161 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.762 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 . . . . . 0 CA--C 1.515 -0.397 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -111.49 106.84 15.85 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-O 121.203 0.525 . . . . 0.0 111.938 -179.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -100.28 108.28 20.3 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.532 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 35.3 t -111.74 134.5 53.27 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.834 -179.169 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -112.54 157.58 20.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.225 179.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.9 p -122.49 120.57 61.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-O 120.87 0.367 . . . . 0.0 110.277 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 93.8 m -95.66 121.17 37.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.562 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -144.1 132.28 21.8 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.019 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.476 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 44.9 t 49.43 32.21 4.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.904 0.383 . . . . 0.0 110.878 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.03 31.54 57.65 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 111.467 -0.653 . . . . 0.0 111.467 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -134.31 128.86 34.6 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 76.2 p -107.73 106.87 17.38 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.027 -179.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -92.82 142.23 27.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.122 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -138.39 160.08 40.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.376 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.9 t -100.32 161.12 13.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.437 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.0 p -90.99 -5.94 54.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.562 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.545 ' N ' ' OE1' ' A' ' 51' ' ' GLU . 55.9 mp0 -117.72 139.89 50.41 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.114 0.483 . . . . 0.0 110.495 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.576 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.62 145.32 24.91 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.919 -179.166 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.524 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -107.9 147.19 34.99 Favored Pre-proline 0 C--N 1.315 -0.913 0 CA-C-N 115.014 -0.993 . . . . 0.0 111.065 179.763 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -77.91 -3.41 13.48 Favored 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 122.736 2.291 . . . . 0.0 112.555 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.476 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 1.2 p -134.26 153.98 51.55 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.007 0.432 . . . . 0.0 111.064 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.17 -63.76 1.01 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.275 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -52.31 -34.41 46.8 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.995 -177.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.476 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 34.6 m -57.55 -33.39 68.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.856 0.36 . . . . 0.0 110.527 179.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.74 -46.22 54.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.164 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -59.04 -34.93 72.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.432 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.523 ' NE2' ' CE1' ' A' ' 5' ' ' TYR . 2.7 t-80 -62.31 -60.01 4.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.872 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.406 ' N ' ' ND1' ' A' ' 61' ' ' HIS . . . -64.91 -34.92 79.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.772 -179.365 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.98 -52.6 65.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.955 -179.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.58 -39.58 80.74 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.81 -179.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -57.18 -48.71 78.07 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.668 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.437 HG21 HD13 ' A' ' 66' ' ' ILE . 96.7 mt -56.82 -46.99 83.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.304 -179.278 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.94 -45.8 73.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.025 0.44 . . . . 0.0 110.431 179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.0 t -57.04 -41.25 77.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.004 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -66.49 -27.24 67.63 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.827 0.346 . . . . 0.0 110.675 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.4 m . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.734 179.961 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.5 m . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 120.784 0.326 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.657 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 5.7 m-85 -58.24 -45.58 87.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.717 -179.185 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -59.43 -41.98 90.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.969 0.414 . . . . 0.0 110.253 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.57 -32.54 83.59 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -76.51 -47.38 22.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.007 0.432 . . . . 0.0 111.158 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.8 tp -62.2 -42.55 99.4 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.303 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -62.61 -41.4 98.97 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 119.692 -0.803 . . . . 0.0 110.691 -178.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.42 -37.39 82.98 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.572 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.617 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 63.0 t80 -61.32 -50.96 70.87 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.669 -179.497 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.77 -47.28 80.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.971 0.415 . . . . 0.0 110.266 -179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.5 tp -62.16 -45.38 93.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.503 -179.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -65.01 -38.18 90.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.506 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.617 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 62.4 m80 -91.17 2.28 56.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.536 -179.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 54.53 65.04 1.61 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.686 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.5 mt -127.65 151.32 49.09 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.089 0.471 . . . . 0.0 110.567 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -47.68 139.26 7.4 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.845 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 pp -52.68 146.19 18.82 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.902 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -72.35 153.24 55.92 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 122.5 2.133 . . . . 0.0 112.119 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.5 t -129.79 131.21 66.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.523 179.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -106.99 152.41 24.02 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.34 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -128.18 110.72 12.7 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 178.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.448 ' OD1' ' O ' ' A' ' 25' ' ' ASN . 40.7 p30 -107.3 144.14 34.56 Favored 'General case' 0 CA--C 1.517 -0.302 0 O-C-N 123.713 0.633 . . . . 0.0 110.987 -178.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.451 ' OE1' ' N ' ' A' ' 27' ' ' ARG . 0.7 OUTLIER -145.04 148.63 33.91 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.252 178.786 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.451 ' N ' ' OE1' ' A' ' 26' ' ' GLU . 61.7 ttp180 . . . . . 0 CA--C 1.516 -0.336 0 CA-C-O 120.648 0.261 . . . . 0.0 110.432 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.9 mmt180 . . . . . 0 CA--C 1.512 -0.497 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -115.04 102.19 9.7 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.332 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 85.7 mtp180 -101.16 106.93 18.22 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 9.9 t -114.87 129.21 56.66 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.016 -179.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -109.39 157.79 18.57 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.665 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.4 p -125.24 121.32 60.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.196 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 99.1 m -98.52 123.93 42.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.737 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -146.23 132.81 19.81 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.312 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.476 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 51.8 t 47.84 45.14 18.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.837 0.351 . . . . 0.0 110.615 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 61.7 31.55 78.41 Favored Glycine 0 CA--C 1.522 0.505 0 N-CA-C 111.244 -0.742 . . . . 0.0 111.244 179.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.432 ' CG ' ' CE1' ' A' ' 47' ' ' PHE . 11.9 tp-100 -136.81 123.31 20.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.843 0.354 . . . . 0.0 110.167 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.97 109.62 21.68 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.299 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.472 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 60.0 m-85 -91.99 141.04 29.05 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.971 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.468 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 2.6 pm0 -149.71 156.02 41.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.176 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.6 t -96.52 170.75 9.0 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.429 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.5 p -99.21 -0.35 41.64 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.543 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -128.23 129.69 46.8 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.187 0.518 . . . . 0.0 110.706 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.436 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -78.92 148.0 32.85 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.992 -179.689 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.479 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -99.2 147.62 33.52 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.165 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -74.88 -6.89 18.71 Favored 'Trans proline' 0 N--CA 1.497 1.71 0 C-N-CA 122.741 2.294 . . . . 0.0 112.457 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 p -133.45 155.0 50.33 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.221 0.534 . . . . 0.0 111.095 -179.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.77 -64.16 0.91 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.425 -178.549 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -53.71 -33.05 54.27 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.805 0.336 . . . . 0.0 110.381 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.4 t -56.92 -36.93 70.77 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.026 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.8 -45.45 71.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.457 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.62 -39.48 84.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.29 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.657 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -64.32 -52.45 58.39 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.256 0.55 . . . . 0.0 110.735 179.949 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.566 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -65.63 -36.0 82.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.111 -178.553 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.81 -49.28 78.28 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.569 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.62 -32.1 70.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.787 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -54.77 -45.37 74.23 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.675 0.274 . . . . 0.0 110.832 -179.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 23.1 pt -74.08 -34.43 38.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 120.935 0.397 . . . . 0.0 110.677 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.53 -50.63 43.22 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.032 0.444 . . . . 0.0 111.666 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.5 p -63.07 -32.38 56.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.2 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.32 -28.08 65.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.57 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 0.472 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 18.5 m . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.688 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.1 m . . . . . 0 N--CA 1.457 -0.081 0 CA-C-O 120.724 0.297 . . . . 0.0 110.674 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -60.33 -45.97 91.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.684 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -61.08 -45.11 96.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.458 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.0 -34.84 90.95 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -73.24 -44.57 59.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.87 0.367 . . . . 0.0 111.227 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 45.6 tp -62.92 -41.19 99.38 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.417 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -64.37 -41.24 96.82 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 119.868 -0.733 . . . . 0.0 110.515 -179.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.73 -37.97 82.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.991 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.613 ' CE1' ' CD2' ' A' ' 16' ' ' HIS . 71.4 t80 -61.52 -50.69 71.69 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.825 -179.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.418 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -55.73 -47.69 76.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.931 0.396 . . . . 0.0 110.329 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.8 tt -63.16 -43.01 99.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.979 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -64.14 -40.97 97.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.627 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.613 ' CD2' ' CE1' ' A' ' 12' ' ' TYR . 78.7 m-70 -89.49 -4.24 58.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.765 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.418 ' N ' ' O ' ' A' ' 13' ' ' ALA . 64.7 t30 61.3 65.32 0.98 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.571 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 78.9 mt -128.51 148.83 50.77 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.601 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.513 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 1.5 mp0 -47.29 147.8 1.47 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.828 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.89 145.28 53.87 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.866 -179.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.68 153.02 64.96 Favored 'Trans proline' 0 N--CA 1.495 1.561 0 C-N-CA 122.4 2.067 . . . . 0.0 111.772 179.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 64.7 t -127.67 130.69 70.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.33 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -107.45 148.69 28.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.695 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.491 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -124.65 111.39 15.56 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.502 ' OD1' ' SG ' ' A' ' 38' ' ' CYS . 45.3 m-80 -109.88 143.55 39.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.735 0.302 . . . . 0.0 110.612 -178.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -148.0 151.25 35.44 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 . . . . . 0 CA--C 1.515 -0.373 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.587 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 . . . . . 0 CA--C 1.519 -0.23 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -111.39 105.98 14.76 Favored 'General case' 0 CA--C 1.5 -0.97 0 C-N-CA 120.266 -0.573 . . . . 0.0 111.744 -178.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 40.9 mtm180 -106.13 113.18 26.56 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.502 ' SG ' ' OD1' ' A' ' 25' ' ' ASN . 43.7 t -119.16 150.94 39.19 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.245 0.545 . . . . 0.0 110.97 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.422 ' OD1' ' NE2' ' A' ' 48' ' ' GLN . 94.7 m-20 -122.34 159.83 26.64 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.19 -0.913 . . . . 0.0 110.344 179.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.5 p -124.05 127.38 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.088 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 99.6 m -105.5 122.84 46.83 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.063 179.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.493 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.0 t80 -145.29 136.13 24.56 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 7.0 m 42.26 31.77 0.28 Allowed 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.057 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.83 25.92 61.55 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 120.994 -0.622 . . . . 0.0 111.653 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.493 ' N ' ' O ' ' A' ' 42' ' ' PHE . 85.3 mt-30 -120.44 124.57 45.78 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.724 0.297 . . . . 0.0 110.627 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.5 p -110.41 99.53 8.53 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.307 0.575 . . . . 0.0 111.012 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -100.3 140.6 34.32 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.211 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.422 ' NE2' ' OD1' ' A' ' 39' ' ' ASN . 57.2 tt0 -145.89 148.95 33.38 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.142 -179.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 44.0 t -87.73 161.72 17.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.378 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 79.0 p -91.6 -2.58 57.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.389 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -112.24 133.97 54.05 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.158 0.504 . . . . 0.0 110.532 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.585 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.68 144.65 25.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.648 -179.438 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.62 149.81 38.84 Favored Pre-proline 0 C--N 1.311 -1.092 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.976 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -80.4 -3.06 12.36 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 123.089 2.526 . . . . 0.0 112.666 179.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.453 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 0.8 OUTLIER -127.77 147.69 50.42 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.327 0.584 . . . . 0.0 111.347 -179.193 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tt -65.51 -61.51 2.06 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.865 -178.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -56.41 -35.83 68.25 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 120.795 0.331 . . . . 0.0 111.197 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.453 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 51.2 m -55.39 -33.35 63.39 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.754 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.31 -41.45 69.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.402 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.432 ' OE2' ' ND2' ' A' ' 25' ' ' ASN . 98.4 mt-10 -65.15 -41.73 94.47 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.92 -179.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -66.37 -45.62 79.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.052 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.01 -36.45 84.44 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.673 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.0 -40.82 86.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.184 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.32 -33.81 74.99 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.824 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -55.22 -46.73 75.95 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.666 0.269 . . . . 0.0 111.173 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.9 pt -71.85 -38.6 65.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.429 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.44 -49.28 61.03 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.0 p -62.07 -31.04 50.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.886 0.374 . . . . 0.0 110.053 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.88 -27.21 62.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.527 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 35.8 t . . . . . 0 C--N 1.332 -0.181 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.82 179.802 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.7 mmm . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.506 ' O ' ' ND1' ' A' ' 3' ' ' HIS . 44.8 p-10 -81.97 172.99 12.63 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.607 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.624 ' ND1' ' CD2' ' A' ' 61' ' ' HIS . 11.6 m-70 -138.87 57.8 1.66 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.804 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.6 m -101.24 -15.88 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.847 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -58.33 -44.56 88.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.887 0.375 . . . . 0.0 111.112 -178.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -60.07 -42.91 95.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.009 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.53 -31.84 82.22 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 111.146 -0.781 . . . . 0.0 111.146 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -76.22 -46.92 25.95 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.671 0.272 . . . . 0.0 111.415 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 51.0 tp -62.35 -41.32 98.49 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.435 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -64.74 -43.09 94.46 Favored 'General case' 0 N--CA 1.44 -0.95 0 C-N-CA 119.821 -0.752 . . . . 0.0 110.323 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.51 -39.06 85.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.735 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE2' ' CE1' ' A' ' 16' ' ' HIS . 55.9 t80 -62.45 -52.45 63.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.729 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.69 -49.47 76.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.82 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.7 tp -63.47 -45.24 91.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.831 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -64.71 -39.86 94.37 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.542 -178.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE2' ' A' ' 12' ' ' TYR . 72.9 m80 -86.21 -7.3 58.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.67 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 63.1 t30 62.91 66.0 0.77 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.417 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.9 mt -127.55 148.18 50.34 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.641 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -44.71 137.22 4.02 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 121.07 0.462 . . . . 0.0 109.994 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.6 mt -48.98 144.3 7.64 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.732 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.53 154.7 55.25 Favored 'Trans proline' 0 N--CA 1.495 1.607 0 C-N-CA 122.398 2.065 . . . . 0.0 111.979 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.8 t -130.04 130.63 66.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-O 121.246 0.546 . . . . 0.0 110.792 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -106.9 152.89 23.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.874 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -116.6 143.74 45.24 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.547 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -121.2 124.81 45.6 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 120.691 0.281 . . . . 0.0 111.197 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -134.73 132.79 39.23 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -133.9 119.56 19.27 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -159.2 133.23 7.57 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 150.98 141.77 3.41 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.247 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_exo -43.48 166.42 0.03 OUTLIER 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 121.877 1.718 . . . . 0.0 112.55 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -54.28 -50.19 14.39 Favored 'Trans proline' 0 N--CA 1.502 1.998 0 C-N-CA 122.464 2.109 . . . . 0.0 113.013 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -88.47 4.34 46.9 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.586 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.14 61.41 20.83 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.462 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -82.08 143.24 12.72 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 C-N-CA 122.628 2.218 . . . . 0.0 111.457 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 85.9 mtt85 -132.87 131.23 40.73 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -114.48 103.34 10.94 Favored 'General case' 0 CA--C 1.501 -0.941 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.112 179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -102.76 107.17 17.95 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.522 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.414 ' O ' ' OE1' ' A' ' 48' ' ' GLN . 69.8 m -113.26 129.82 56.42 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.427 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.421 ' OD1' ' OE1' ' A' ' 48' ' ' GLN . 60.0 m-80 -105.56 150.85 25.01 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.77 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.0 p -120.36 119.68 60.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 98.5 m -97.32 122.3 40.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.307 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -144.64 135.95 25.31 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.324 -0.398 . . . . 0.0 109.965 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.492 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 43.4 t 47.35 36.3 4.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.925 0.393 . . . . 0.0 110.907 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.454 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 69.56 32.11 71.09 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.332 -0.707 . . . . 0.0 111.332 179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.454 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 98.8 mm-40 -135.17 128.27 31.73 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.731 0.301 . . . . 0.0 110.39 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 55.2 p -107.53 106.83 17.39 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.979 0.419 . . . . 0.0 111.129 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -92.72 141.71 28.16 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.039 179.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.421 ' OE1' ' OD1' ' A' ' 39' ' ' ASN . 69.9 tp60 -152.89 145.55 24.27 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.416 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 92.6 p -86.94 161.2 18.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.412 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.0 p -88.65 -4.05 58.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.895 0.378 . . . . 0.0 110.101 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -112.96 146.62 38.69 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.516 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.68 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -99.96 135.85 40.77 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 121.893 0.854 . . . . 0.0 109.538 -179.97 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.456 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -89.59 150.72 44.83 Favored Pre-proline 0 C--N 1.307 -1.259 0 CA-C-N 114.119 -1.401 . . . . 0.0 110.723 -179.544 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -79.76 -4.57 13.52 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 C-N-CA 122.496 2.13 . . . . 0.0 112.465 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.42 153.44 51.79 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.936 0.398 . . . . 0.0 111.02 -179.145 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.23 -62.82 1.32 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.657 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -55.66 -32.91 63.62 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 120.802 0.334 . . . . 0.0 110.734 -177.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.2 t -56.84 -37.79 71.76 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.829 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.14 -41.71 81.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.057 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -63.5 -44.05 95.48 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.753 0.311 . . . . 0.0 110.841 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.624 ' CD2' ' ND1' ' A' ' 3' ' ' HIS . 32.7 m-70 -62.06 -48.03 82.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.394 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.52 -36.01 81.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.533 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.65 -48.19 81.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.369 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.68 -33.32 75.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.953 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -54.97 -47.33 74.69 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.614 0.245 . . . . 0.0 111.061 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.4 pt -74.08 -32.21 32.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.5 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.446 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -68.37 -50.29 54.18 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.769 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 p -65.1 -29.98 48.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.743 0.306 . . . . 0.0 110.502 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.24 -33.59 73.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.916 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.446 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 86.1 p -67.3 -38.67 85.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.956 0.408 . . . . 0.0 110.566 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 53.8 mt -67.24 -31.53 71.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.693 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 29.1 m . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.585 -179.98 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.3 mtm . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.411 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 95.9 m-20 -69.85 141.13 53.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.36 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.456 ' O ' ' CD2' ' A' ' 3' ' ' HIS . 55.7 p-80 -159.34 43.59 0.24 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.775 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.2 m -93.78 -15.29 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-O 120.737 0.303 . . . . 0.0 110.855 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -57.91 -44.82 87.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.719 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -58.1 -42.54 85.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.365 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -66.92 -29.74 75.08 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -77.22 -49.3 15.42 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.009 0.433 . . . . 0.0 111.264 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 56.2 tp -62.84 -41.82 99.5 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.445 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -64.7 -40.41 95.32 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 119.538 -0.865 . . . . 0.0 110.611 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.32 -38.32 81.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.557 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -62.13 -49.78 74.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.803 -179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.412 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -57.33 -47.88 80.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.881 0.372 . . . . 0.0 110.39 -179.518 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.2 tp -61.89 -46.2 90.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.615 -179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -65.7 -39.59 91.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.781 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.499 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 60.0 t-80 -88.37 -0.87 57.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.601 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.412 ' N ' ' O ' ' A' ' 13' ' ' ALA . 80.7 m-20 56.17 65.54 1.41 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.671 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 81.7 mt -127.07 148.87 50.13 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.413 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -46.34 134.58 8.79 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.752 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.3 mt -46.91 144.8 3.56 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.692 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.89 153.5 63.72 Favored 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 122.215 1.944 . . . . 0.0 111.878 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 73.6 t -129.83 130.43 66.52 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.339 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -106.37 152.77 23.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.41 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.527 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -117.53 140.54 49.48 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.279 178.289 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -119.47 125.66 49.44 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.962 0.41 . . . . 0.0 111.319 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -135.0 133.84 39.86 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.061 178.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 69.8 ttp85 -133.42 119.99 20.34 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.172 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -159.1 132.77 7.39 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.495 -0.482 . . . . 0.0 109.751 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 150.08 143.37 3.73 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 120.444 -0.884 . . . . 0.0 111.272 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -43.83 165.94 0.04 OUTLIER 'Trans proline' 0 N--CA 1.491 1.334 0 C-N-CA 121.914 1.743 . . . . 0.0 112.61 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.41 -51.37 11.08 Favored 'Trans proline' 0 N--CA 1.499 1.833 0 C-N-CA 122.539 2.159 . . . . 0.0 112.841 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 51.5 p-80 -88.06 5.84 39.1 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.565 -179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.33 60.95 18.27 Favored Pre-proline 0 C--N 1.332 -0.191 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.825 178.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -81.1 142.29 13.52 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 122.668 2.245 . . . . 0.0 111.545 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 91.1 mtm180 -131.29 130.15 42.43 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -113.67 103.55 11.34 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.217 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -99.62 106.33 18.29 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.527 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 45.1 t -112.23 124.42 52.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.489 -179.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -107.77 151.58 25.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.079 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.0 p -120.59 120.03 61.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.303 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.165 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 87.2 m -96.07 121.42 37.8 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.283 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.556 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 5.0 t80 -142.18 138.99 31.93 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.189 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.556 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 4.0 m 45.25 31.98 0.9 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.743 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 74.88 32.17 57.22 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 42' ' ' PHE . 86.6 mt-30 -136.59 126.76 26.29 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 45.7 p -104.86 106.89 17.58 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.957 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.491 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 51.8 m-85 -91.3 140.95 29.3 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.201 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -150.1 150.77 32.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.372 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.69 ' HG ' ' H ' ' A' ' 51' ' ' GLU . 29.3 t -91.31 164.38 13.88 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.515 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.8 m -89.41 -7.39 55.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.584 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.69 ' H ' ' HG ' ' A' ' 49' ' ' SER . 96.4 mt-10 -117.66 136.9 53.02 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.323 0.582 . . . . 0.0 110.188 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.526 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -90.22 144.13 26.13 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.55 -179.07 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -95.61 148.97 35.44 Favored Pre-proline 0 C--N 1.317 -0.806 0 CA-C-N 114.757 -1.11 . . . . 0.0 111.174 -179.66 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -80.37 -3.81 12.74 Favored 'Trans proline' 0 N--CA 1.494 1.547 0 C-N-CA 122.848 2.365 . . . . 0.0 111.941 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.433 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -130.14 154.02 47.92 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.228 0.537 . . . . 0.0 110.822 -179.346 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.1 tt -70.25 -64.99 0.78 Allowed 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.475 -178.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -55.19 -35.53 64.92 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 120.98 0.419 . . . . 0.0 110.554 -178.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.433 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 58.3 m -55.32 -34.8 64.51 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.016 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.81 -40.3 72.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.782 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -63.03 -41.25 99.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.331 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.411 ' ND1' ' O ' ' A' ' 2' ' ' ASP . 35.6 m170 -63.76 -49.22 73.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.794 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.57 -35.43 79.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.926 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.94 -48.64 79.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.783 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.47 -33.53 74.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.053 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -54.9 -45.24 74.69 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.685 0.279 . . . . 0.0 111.456 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 22.1 pt -73.27 -33.94 42.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.578 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.59 -50.52 43.81 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.705 -178.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.9 p -63.49 -32.26 56.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.188 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.25 -30.24 68.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.715 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.491 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 15.7 m -67.33 -42.06 84.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.762 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 52.1 mt -67.07 -30.47 70.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.756 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 59.8 p . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 118.136 -0.935 . . . . 0.0 110.638 -179.62 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.3 mtt . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' A' ' 3' ' ' HIS . 68.1 t0 -65.47 137.72 57.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.46 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.622 ' ND1' ' NE2' ' A' ' 61' ' ' HIS . 23.9 m170 -82.94 75.09 9.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.569 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.7 m -96.77 -15.75 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.76 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -56.45 -46.17 80.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.804 -179.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -60.83 -41.98 96.85 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.632 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.85 -33.44 85.79 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -77.74 -49.87 13.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.237 0.541 . . . . 0.0 111.235 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 29.5 tp -62.09 -42.32 99.09 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.169 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -62.85 -41.89 99.54 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.683 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.83 -36.54 80.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.49 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.621 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 83.1 t80 -61.22 -50.61 72.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.816 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.41 -51.53 69.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.904 0.383 . . . . 0.0 110.663 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 51.2 tp -62.85 -44.12 96.99 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.732 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 69.8 tp60 -64.11 -38.49 91.25 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.569 -178.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 68.1 m80 -91.78 -0.46 57.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.718 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 64.7 t30 58.04 66.33 1.13 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.592 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.9 mt -127.93 146.62 50.58 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.017 0.437 . . . . 0.0 110.575 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 57.0 mp0 -42.62 133.4 3.44 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.103 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.404 ' N ' ' CD1' ' A' ' 20' ' ' LEU . 10.5 mp -47.2 145.55 3.55 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.691 -178.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.42 153.71 55.6 Favored 'Trans proline' 0 N--CA 1.492 1.441 0 C-N-CA 122.497 2.131 . . . . 0.0 111.881 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 67.3 t -128.85 131.87 67.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.324 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -107.34 152.88 23.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.672 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -115.91 144.47 44.0 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.456 178.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -124.95 123.6 40.23 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.288 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 83.9 mt-10 -133.87 130.72 38.24 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -130.14 119.99 23.88 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 120.788 0.328 . . . . 0.0 110.286 -179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -158.87 131.94 7.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.081 0.467 . . . . 0.0 109.898 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.67 141.88 3.49 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 120.432 -0.889 . . . . 0.0 111.223 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_exo -43.88 165.01 0.04 OUTLIER 'Trans proline' 0 C--N 1.314 -1.276 0 C-N-CA 122.222 1.948 . . . . 0.0 112.419 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -53.46 -50.97 12.04 Favored 'Trans proline' 0 N--CA 1.496 1.669 0 C-N-CA 122.48 2.12 . . . . 0.0 112.734 179.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -86.55 3.24 45.1 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.545 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.08 60.95 18.98 Favored Pre-proline 0 C--N 1.331 -0.204 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.893 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -80.8 143.45 14.73 Favored 'Trans proline' 0 C--N 1.311 -1.434 0 C-N-CA 122.642 2.228 . . . . 0.0 111.951 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 87.5 mtm180 -133.18 130.16 38.76 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -114.22 103.78 11.44 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.036 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -102.34 105.36 15.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.12 0.486 . . . . 0.0 109.731 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 69.0 m -114.08 132.93 55.86 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.452 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -111.41 155.52 23.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.293 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.9 p -121.11 119.9 60.62 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.301 0 CA-C-O 120.923 0.392 . . . . 0.0 109.95 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 74.8 m -97.33 124.88 41.61 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.681 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -146.08 136.83 24.29 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.125 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.441 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 49.6 t 46.76 32.82 1.88 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.808 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.45 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 74.11 32.85 57.98 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 111.236 -0.745 . . . . 0.0 111.236 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 98.8 mm-40 -136.56 123.62 21.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.804 0.335 . . . . 0.0 110.217 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.2 p -106.13 108.73 20.4 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.115 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -94.5 141.6 28.4 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.007 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -147.86 145.91 28.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.892 0.377 . . . . 0.0 110.422 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.437 ' HG ' ' H ' ' A' ' 51' ' ' GLU . 6.1 p -84.7 163.18 19.36 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.307 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.1 p -90.86 -2.51 57.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.536 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.437 ' H ' ' HG ' ' A' ' 49' ' ' SER . 97.3 mt-10 -118.29 154.43 32.3 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.222 0.534 . . . . 0.0 110.105 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.687 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -103.68 134.26 47.31 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.909 -179.405 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.43 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -88.02 147.54 40.99 Favored Pre-proline 0 C--N 1.311 -1.107 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.935 -179.838 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.15 -5.33 16.16 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.759 2.306 . . . . 0.0 112.381 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.435 ' O ' ' OG ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -136.06 155.79 49.69 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.001 0.429 . . . . 0.0 111.107 -179.216 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.97 -64.13 0.92 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.93 -178.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -54.22 -36.17 63.22 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.937 -177.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.435 ' OG ' ' O ' ' A' ' 55' ' ' THR . 77.8 p -56.05 -33.02 64.58 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.14 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.67 -42.24 67.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.896 0.379 . . . . 0.0 111.128 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -64.21 -42.14 96.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.532 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.622 ' NE2' ' ND1' ' A' ' 3' ' ' HIS . 43.7 m-70 -66.17 -46.8 76.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.718 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.66 -37.98 83.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.762 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.25 -45.47 94.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.687 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.6 -37.07 77.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.364 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.36 -50.03 75.1 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.356 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 96.6 mt -57.82 -47.78 85.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.216 -178.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.6 -43.88 88.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.008 0.432 . . . . 0.0 110.501 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.2 t -59.48 -41.21 83.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.142 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.08 -29.88 70.78 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.652 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 19.7 m -65.17 -41.63 94.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.793 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 56.4 mt -67.59 -29.87 69.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.541 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 43.1 p . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.626 -179.767 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.6 mmm . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -63.17 -42.49 99.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.593 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.51 ' O ' ' CG ' ' A' ' 3' ' ' HIS . 36.2 p-80 -167.26 59.12 0.08 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.589 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.5 m -99.41 -14.93 7.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.452 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -60.31 -44.94 94.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.796 0.332 . . . . 0.0 110.815 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -59.1 -41.66 88.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.533 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.6 -28.01 73.44 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -77.64 -49.61 14.18 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.021 0.438 . . . . 0.0 111.018 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.1 tp -61.63 -42.16 98.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.723 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -62.23 -40.14 95.17 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.833 -179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.28 -38.07 78.18 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.408 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.618 ' CE1' ' CD2' ' A' ' 16' ' ' HIS . 83.9 t80 -62.05 -51.7 66.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.609 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.492 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.81 -49.21 76.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.514 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 51.5 tp -62.41 -44.79 95.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.636 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -65.35 -39.48 92.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.588 -179.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.618 ' CD2' ' CE1' ' A' ' 12' ' ' TYR . 66.5 m-70 -90.28 -5.71 55.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.6 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.492 ' N ' ' O ' ' A' ' 13' ' ' ALA . 64.5 t30 60.72 67.12 0.85 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.559 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 75.7 mt -126.66 148.12 49.86 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.937 0.398 . . . . 0.0 110.584 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.481 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 55.4 mp0 -42.51 131.92 3.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.269 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 pp -46.08 144.57 2.93 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.635 -179.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -72.53 155.42 54.93 Favored 'Trans proline' 0 C--N 1.308 -1.585 0 C-N-CA 122.769 2.313 . . . . 0.0 112.167 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 59.1 t -130.69 132.02 64.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.458 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -108.88 153.54 23.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.765 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -116.16 144.06 44.67 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.817 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -123.61 122.91 39.37 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.937 -179.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -132.39 126.84 34.1 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.735 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -129.99 118.99 22.47 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.844 0.354 . . . . 0.0 110.374 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.515 ' CD ' HH21 ' A' ' 37' ' ' ARG . 11.5 pt-20 -159.55 134.66 8.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.344 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 147.79 144.0 3.92 Favored Glycine 0 CA--C 1.531 1.046 0 N-CA-C 111.144 -0.782 . . . . 0.0 111.144 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -42.49 162.87 0.04 OUTLIER 'Trans proline' 0 C--N 1.309 -1.509 0 C-N-CA 122.666 2.244 . . . . 0.0 112.425 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -53.45 -48.08 23.86 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.523 2.149 . . . . 0.0 112.433 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -89.56 5.16 46.79 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.62 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.7 60.65 16.55 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.66 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -79.65 142.92 16.48 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.597 2.198 . . . . 0.0 111.901 178.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 85.0 mtt85 -131.56 128.94 40.3 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.212 179.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -113.65 104.03 11.82 Favored 'General case' 0 C--O 1.217 -0.635 0 C-N-CA 120.479 -0.488 . . . . 0.0 111.335 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.515 HH21 ' CD ' ' A' ' 28' ' ' GLU . 86.9 mtm180 -106.21 104.38 14.07 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 81.2 m -113.08 133.53 54.96 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.309 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -111.34 153.98 25.21 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.313 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.4 p -121.3 119.7 59.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 121.032 0.444 . . . . 0.0 110.159 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 98.0 m -97.07 123.3 40.78 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.788 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -145.26 136.95 25.39 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.325 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.492 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 43.9 t 46.54 36.05 3.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.528 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.433 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 70.56 32.77 67.48 Favored Glycine 0 CA--C 1.52 0.371 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.433 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 98.2 mm-40 -136.25 125.54 24.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.722 0.296 . . . . 0.0 110.342 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.0 p -106.83 107.54 18.61 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.965 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.526 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 54.5 m-85 -92.85 140.94 28.98 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.008 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -147.65 151.08 35.58 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.392 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.6 m -88.74 160.68 17.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.463 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 86.8 p -86.37 -7.74 58.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.548 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -127.64 132.16 49.78 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.412 0.625 . . . . 0.0 110.771 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -80.28 148.75 30.61 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.136 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.556 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -98.1 149.69 35.99 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.875 -179.756 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -75.68 -4.39 15.17 Favored 'Trans proline' 0 C--N 1.311 -1.41 0 C-N-CA 122.764 2.309 . . . . 0.0 112.357 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.473 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -130.54 153.23 49.07 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.235 0.541 . . . . 0.0 110.722 -179.343 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.1 tt -69.7 -66.46 0.59 Allowed 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.293 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -53.41 -36.59 61.65 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.515 -178.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.473 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 79.1 p -54.73 -32.38 59.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.284 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.27 -40.73 70.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.856 0.36 . . . . 0.0 110.813 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -64.91 -38.67 91.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.477 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 22.9 m170 -64.58 -51.77 61.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.81 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.38 -34.33 77.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.645 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.19 -46.76 85.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.639 -179.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.03 -32.71 70.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.651 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -54.18 -45.34 72.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.825 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.8 pt -74.22 -32.87 33.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.068 0.461 . . . . 0.0 110.804 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.18 -50.27 41.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.239 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.6 p -64.36 -31.18 52.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.626 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.42 -28.78 65.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.524 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.526 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 15.6 m -70.06 -39.82 75.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.063 0.458 . . . . 0.0 110.661 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.403 ' O ' ' OG1' ' A' ' 72' ' ' THR . 51.5 mt -67.37 -29.56 69.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.566 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 71' ' ' LEU . 82.0 p . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.46 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.2 mtm . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 54.99 33.87 21.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.519 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.633 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 6.2 t60 -73.58 60.52 0.67 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.768 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 24.1 m -92.67 -15.24 8.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.999 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -59.19 -44.37 92.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.834 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -58.51 -43.09 88.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.258 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.41 -28.27 73.33 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 111.234 -0.746 . . . . 0.0 111.234 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -77.4 -49.58 14.58 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.88 0.372 . . . . 0.0 110.978 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 59.0 tp -63.21 -41.2 99.1 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.323 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -62.49 -41.28 98.69 Favored 'General case' 0 C--N 1.311 -1.101 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.623 -179.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.09 -37.85 81.68 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.934 179.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 80.5 t80 -61.67 -51.22 69.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.775 -179.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.32 -48.5 80.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.434 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.3 tp -62.73 -44.24 96.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.469 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.9 tp60 -65.24 -40.19 93.71 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.601 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 69.1 m80 -89.55 -1.69 58.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.692 -179.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 60.9 t-20 58.59 65.95 1.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.546 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.8 mt -127.4 151.15 49.17 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.583 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -45.58 129.52 8.75 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.722 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.35 146.27 2.4 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.598 -178.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.26 152.88 66.97 Favored 'Trans proline' 0 N--CA 1.494 1.501 0 C-N-CA 122.396 2.064 . . . . 0.0 112.041 179.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.1 t -129.83 129.39 66.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.535 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -104.73 152.61 22.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.331 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.515 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -117.93 145.24 44.82 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.526 178.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -121.5 125.62 47.26 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.665 0.269 . . . . 0.0 111.245 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -134.69 123.64 24.02 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 -125.02 113.47 17.82 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -148.95 128.48 13.12 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.78 139.35 3.06 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 120.488 -0.863 . . . . 0.0 111.331 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -44.1 166.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 121.875 1.717 . . . . 0.0 112.743 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -54.93 -47.7 25.21 Favored 'Trans proline' 0 N--CA 1.502 1.974 0 C-N-CA 122.357 2.038 . . . . 0.0 112.455 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -86.47 -0.55 56.28 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.526 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.84 60.57 19.17 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.709 178.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -81.93 144.49 13.62 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 122.6 2.2 . . . . 0.0 111.731 178.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.401 ' NH2' ' CD1' ' A' ' 52' ' ' PHE . 82.8 mtp180 -131.86 131.0 42.41 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 178.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -114.96 103.83 11.31 Favored 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 120.161 -0.616 . . . . 0.0 111.296 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.7 mtm180 -101.77 106.36 17.35 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.077 0.465 . . . . 0.0 110.226 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.515 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 42.1 t -109.79 124.5 51.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.375 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -106.63 150.55 26.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.711 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.4 p -119.28 119.46 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.11 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 94.8 m -94.66 120.19 34.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.212 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.486 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 4.5 t80 -141.36 138.01 32.74 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.203 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.486 ' SG ' ' O ' ' A' ' 42' ' ' PHE . 13.8 p 41.9 44.13 2.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.945 0.402 . . . . 0.0 110.718 179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 64.64 32.63 84.84 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.443 ' N ' ' O ' ' A' ' 42' ' ' PHE . 47.6 tp60 -137.73 122.51 18.76 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.912 0.387 . . . . 0.0 110.384 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 32.7 p -103.69 109.08 20.64 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.129 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.499 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 15.9 m-85 -89.9 140.74 29.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.859 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -144.95 154.01 42.13 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.341 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.1 m -98.62 159.85 14.67 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.415 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 93.7 p -89.88 -6.88 55.35 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.56 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -116.26 148.88 40.03 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.146 0.498 . . . . 0.0 110.189 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.689 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -101.59 131.26 47.88 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-N 115.228 -0.897 . . . . 0.0 109.822 -179.331 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.462 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -85.98 148.84 49.06 Favored Pre-proline 0 C--N 1.307 -1.247 0 CA-C-N 114.142 -1.39 . . . . 0.0 110.688 -179.566 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -77.42 -5.17 15.39 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 122.395 2.064 . . . . 0.0 112.563 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 48.7 m -135.43 153.09 51.9 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.255 0.55 . . . . 0.0 111.179 -179.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.7 -62.56 1.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.554 -178.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.47 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 69.0 mttm -55.07 -33.63 62.91 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 120.992 0.425 . . . . 0.0 110.601 -177.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.4 t -56.46 -36.93 69.62 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.003 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.87 -41.62 74.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.7 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -61.13 -40.81 95.2 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.42 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.633 ' ND1' ' CE1' ' A' ' 3' ' ' HIS . 0.4 OUTLIER -67.5 -44.87 77.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.656 -179.525 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.92 -40.85 87.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.074 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.77 -50.68 72.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.682 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.33 -37.73 84.34 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.351 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -55.81 -45.89 78.17 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.881 0.372 . . . . 0.0 110.324 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.62 -43.82 93.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.862 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.437 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -67.24 -49.56 64.01 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.4 p -65.05 -31.77 55.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.175 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.95 -27.56 65.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.633 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 59.7 p -71.53 -39.18 70.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.599 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 49.9 mt -67.51 -31.25 71.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.75 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 62.7 m . . . . . 0 C--O 1.221 -0.418 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.562 179.986 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.5 mtt . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -69.21 146.68 52.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.339 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.632 ' ND1' ' CD2' ' A' ' 61' ' ' HIS . 79.5 m-70 -123.07 31.85 5.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.604 -179.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 32.7 m -84.47 -20.16 8.76 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.094 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -55.77 -43.74 77.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.828 0.346 . . . . 0.0 110.923 -178.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -59.88 -42.59 94.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.437 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -74.55 -26.32 67.95 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.66 -0.576 . . . . 0.0 111.66 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -77.17 -49.02 16.1 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.655 0.264 . . . . 0.0 111.506 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.6 tp -63.58 -41.37 98.38 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.179 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -65.12 -42.13 94.22 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.257 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.14 -37.57 84.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.667 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 92.4 t80 -61.5 -48.93 78.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.657 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.441 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.82 -45.83 82.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.798 0.332 . . . . 0.0 110.521 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.3 tp -62.86 -46.17 89.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.729 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -66.04 -42.68 89.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.966 0.413 . . . . 0.0 110.627 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.481 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 66.9 t-80 -84.8 -5.43 59.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.831 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.441 ' N ' ' O ' ' A' ' 13' ' ' ALA . 61.7 t-20 58.66 65.46 1.24 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.716 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.5 mt -123.38 148.37 46.14 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.683 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -41.72 152.64 0.07 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.302 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.445 ' CD2' ' N ' ' A' ' 20' ' ' LEU . 3.6 mm? -61.61 139.43 95.18 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.468 -178.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -72.07 152.89 57.32 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 122.362 2.042 . . . . 0.0 112.013 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 72.2 t -131.45 130.96 63.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.935 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -107.28 152.22 24.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.422 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.512 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -115.94 141.53 47.99 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 115.602 -0.727 . . . . 0.0 109.133 178.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -119.8 125.14 47.84 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.751 0.31 . . . . 0.0 111.353 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -134.01 128.69 34.87 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -131.11 119.72 22.35 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -158.4 132.55 7.95 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 147.43 147.57 4.57 Favored Glycine 0 CA--C 1.538 1.469 0 C-N-CA 120.596 -0.811 . . . . 0.0 111.92 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -44.71 160.27 0.11 Allowed 'Trans proline' 0 N--CA 1.501 1.966 0 C-N-CA 122.194 1.929 . . . . 0.0 112.035 178.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -57.18 -44.7 41.22 Favored 'Trans proline' 0 N--CA 1.504 2.095 0 C-N-CA 122.704 2.269 . . . . 0.0 112.285 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -86.1 -2.13 58.04 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.071 0.462 . . . . 0.0 110.293 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.93 61.28 17.69 Favored Pre-proline 0 N--CA 1.462 0.168 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.496 178.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -81.29 145.95 15.39 Favored 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.706 2.271 . . . . 0.0 111.458 179.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -129.4 128.46 43.06 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -114.54 103.07 10.65 Favored 'General case' 0 CA--C 1.498 -1.029 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.963 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.9 mmm-85 -101.31 107.41 18.76 Favored 'General case' 0 C--N 1.316 -0.856 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.386 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.512 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 43.7 t -111.85 126.21 54.85 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.787 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -106.36 152.98 22.87 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 p -121.14 120.4 62.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.279 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 52.1 m -98.22 120.44 38.64 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.913 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.497 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 6.3 t80 -144.06 137.35 27.53 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.264 -0.425 . . . . 0.0 109.988 -179.689 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.497 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 7.6 m 47.46 40.04 10.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.832 0.349 . . . . 0.0 110.754 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 66.02 31.72 80.31 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 111.598 -0.601 . . . . 0.0 111.598 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -135.83 126.01 26.31 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.746 0.307 . . . . 0.0 110.355 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 27.6 m -107.51 108.83 20.32 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.877 0.37 . . . . 0.0 110.852 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -93.31 141.92 27.9 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.744 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -142.94 144.23 32.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.593 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.5 p -84.11 162.19 20.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.634 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.7 p -93.3 -7.53 44.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.225 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -116.96 152.58 34.27 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.364 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.699 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -103.73 132.48 49.94 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.85 0.833 . . . . 0.0 109.735 -179.671 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.442 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -87.48 149.42 46.58 Favored Pre-proline 0 C--N 1.303 -1.423 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.454 -179.855 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.12 -5.1 14.91 Favored 'Trans proline' 0 N--CA 1.494 1.515 0 C-N-CA 122.588 2.192 . . . . 0.0 112.704 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 51.6 m -135.09 150.95 50.32 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.875 0.369 . . . . 0.0 111.201 -178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.31 -61.73 2.16 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.734 -178.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.523 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 68.8 mttm -54.95 -34.44 63.27 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 120.792 0.33 . . . . 0.0 110.91 -178.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.2 t -55.57 -38.42 69.33 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.066 0.46 . . . . 0.0 109.849 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.59 -41.68 79.28 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.345 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -64.12 -43.67 94.58 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.764 0.316 . . . . 0.0 110.821 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.632 ' CD2' ' ND1' ' A' ' 3' ' ' HIS . 84.8 m-70 -67.38 -45.61 75.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.674 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.0 -40.37 87.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.2 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.01 -45.37 93.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.839 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.95 -38.19 78.48 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.527 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -57.83 -48.45 79.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.789 179.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.6 mt -57.87 -48.88 82.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.166 -178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.03 -43.47 92.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.639 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 20.8 t -59.14 -42.58 87.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 109.994 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.99 -29.86 71.15 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.929 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.8 t -65.43 -43.36 90.71 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 120.876 0.369 . . . . 0.0 111.285 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 53.4 mt -65.94 -31.17 71.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.591 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 75.6 p . . . . . 0 C--O 1.219 -0.521 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.503 179.878 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.0 mtp . . . . . 0 N--CA 1.489 1.493 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.523 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 25.2 p-10 -92.36 -0.91 57.34 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.687 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.62 ' CD2' ' CE1' ' A' ' 61' ' ' HIS . 22.6 t-160 -145.35 30.89 1.11 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.065 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.9 m -92.96 -16.97 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.776 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.418 ' CD1' ' N ' ' A' ' 5' ' ' TYR . 6.0 m-85 -61.43 -42.79 99.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.8 0.334 . . . . 0.0 111.063 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -59.33 -39.6 83.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.412 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.28 -24.34 59.36 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -77.28 -50.1 13.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.149 0.5 . . . . 0.0 110.859 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.5 tp -63.27 -41.79 99.06 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.328 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.0 tp-100 -60.79 -41.3 95.3 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 120.086 -0.645 . . . . 0.0 110.803 -178.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.67 -37.3 86.12 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.426 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 81.0 t80 -61.35 -49.87 75.21 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.898 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.488 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.96 -49.39 75.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.953 0.406 . . . . 0.0 110.293 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.2 tp -62.78 -44.25 96.66 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.581 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -64.17 -37.32 87.05 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.698 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 59.3 m80 -94.83 -2.36 50.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.7 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 13' ' ' ALA . 55.2 t-20 59.29 66.57 1.01 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.715 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 71.5 mt -124.49 149.96 46.29 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.459 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -46.06 134.58 8.16 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.906 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.91 146.73 2.57 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.745 -178.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.36 154.66 45.93 Favored 'Trans proline' 0 N--CA 1.496 1.631 0 C-N-CA 122.758 2.306 . . . . 0.0 112.354 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.0 t -129.9 130.38 66.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.379 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -107.42 152.34 24.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.857 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -119.68 134.87 55.06 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -115.59 125.68 53.25 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.983 0.42 . . . . 0.0 111.516 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -129.83 127.75 40.91 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.515 178.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 -129.47 117.82 21.13 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 120.657 0.265 . . . . 0.0 110.314 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -157.17 130.75 8.03 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 150.65 139.77 3.08 Favored Glycine 0 CA--C 1.533 1.178 0 C-N-CA 120.506 -0.854 . . . . 0.0 111.204 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_exo -43.79 162.93 0.05 OUTLIER 'Trans proline' 0 C--N 1.314 -1.287 0 C-N-CA 122.243 1.962 . . . . 0.0 112.542 179.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -52.08 -48.95 19.04 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.414 2.076 . . . . 0.0 112.543 179.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -86.77 0.48 54.68 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.593 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.12 61.55 21.59 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.025 179.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -82.68 144.47 12.48 Favored 'Trans proline' 0 C--N 1.308 -1.574 0 C-N-CA 122.748 2.298 . . . . 0.0 111.893 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 87.5 mtm180 -133.57 130.4 38.36 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -113.78 104.13 11.9 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.461 -0.496 . . . . 0.0 111.144 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.584 ' NH2' ' NE2' ' A' ' 48' ' ' GLN . 81.1 mtp85 -106.34 105.46 15.5 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.1 m -119.15 144.0 46.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.067 0.461 . . . . 0.0 110.203 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.401 ' OD1' ' C ' ' A' ' 39' ' ' ASN . 13.6 p30 -124.3 160.1 28.78 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.452 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.1 p -120.28 120.69 63.63 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.253 0 CA-C-O 121.119 0.485 . . . . 0.0 110.202 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 66.7 m -95.9 116.96 29.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.152 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -139.34 137.36 35.71 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.97 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.497 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 43.1 t 48.04 32.3 2.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.814 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.86 33.52 57.5 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -137.87 122.86 19.03 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 18.7 p -105.02 109.56 21.61 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.05 -179.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -95.12 141.42 28.77 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.084 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.584 ' NE2' ' NH2' ' A' ' 37' ' ' ARG . 58.0 tt0 -148.31 144.51 27.63 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.856 0.36 . . . . 0.0 110.546 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.3 p -84.3 163.13 19.81 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.631 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.0 m -89.76 -7.34 54.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.648 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -112.28 148.94 33.11 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.128 0.49 . . . . 0.0 109.929 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.685 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -101.61 131.95 47.54 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.481 -179.615 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.503 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -86.43 148.29 46.45 Favored Pre-proline 0 C--N 1.307 -1.257 0 CA-C-N 114.076 -1.42 . . . . 0.0 111.131 -179.489 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -77.42 -8.38 17.25 Favored 'Trans proline' 0 N--CA 1.495 1.584 0 C-N-CA 122.674 2.25 . . . . 0.0 111.984 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 41.5 m -129.07 148.4 51.02 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.772 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.4 tt -63.83 -61.9 1.99 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.159 -178.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -54.49 -34.21 61.21 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 121.028 -0.269 . . . . 0.0 110.741 -178.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.5 t -55.89 -34.03 65.17 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.104 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.87 -41.98 67.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.158 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -63.99 -41.68 97.43 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.663 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.62 ' CE1' ' CD2' ' A' ' 3' ' ' HIS . 5.2 m-70 -66.99 -47.76 70.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.811 0.339 . . . . 0.0 110.83 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.51 -38.29 84.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.606 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.8 -48.37 82.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.597 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.06 -36.81 80.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.366 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.0 -47.43 83.05 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 97.1 mt -59.69 -45.92 93.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.106 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.32 -43.29 86.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.087 0.47 . . . . 0.0 110.41 179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.1 t -59.56 -42.3 87.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.216 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.05 -27.45 69.11 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.969 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.4 t -67.08 -42.08 85.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.557 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 52.5 mt -66.19 -30.25 70.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.643 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.221 -0.432 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.719 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.3 mtt . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 42.2 -111.1 0.15 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.557 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -147.46 110.02 4.64 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.287 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.4 m -98.24 -15.52 7.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 CA-C-O 120.58 0.229 . . . . 0.0 110.936 179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.639 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 4.7 m-85 -58.14 -42.97 87.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.862 -178.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.529 ' NZ ' ' OE1' ' A' ' 60' ' ' GLU . 98.8 mttt -59.45 -40.37 86.62 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.213 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -69.99 -28.15 72.13 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.202 -0.759 . . . . 0.0 111.202 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -77.28 -50.68 12.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.103 0.478 . . . . 0.0 111.357 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 56.1 tp -62.38 -41.51 98.7 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.259 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -62.53 -39.62 94.16 Favored 'General case' 0 C--N 1.31 -1.134 0 C-N-CA 119.641 -0.824 . . . . 0.0 110.035 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.42 -39.39 77.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.82 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -61.78 -52.61 63.52 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.031 -179.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.87 -47.86 79.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.021 0.439 . . . . 0.0 110.304 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.8 tp -62.56 -44.41 96.39 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.593 -179.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -65.03 -40.89 95.49 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.597 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.525 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 64.8 t-80 -87.03 -2.8 58.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.77 -179.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 58.72 65.56 1.22 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.888 0.375 . . . . 0.0 110.185 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.8 mt -128.67 147.43 50.74 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.498 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -41.7 133.41 2.73 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.568 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.5 mt -48.13 144.39 5.99 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.96 -179.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -70.6 153.94 64.74 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.317 2.012 . . . . 0.0 111.952 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.5 t -131.43 130.54 62.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.636 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -105.22 153.11 22.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.447 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.528 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -119.57 140.81 49.96 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.371 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -118.05 126.69 52.77 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.787 0.327 . . . . 0.0 111.205 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -136.5 131.16 33.59 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 178.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.9 ttp85 -130.24 119.49 22.98 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -157.83 132.07 8.22 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 150.57 140.64 3.23 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 120.23 -0.986 . . . . 0.0 111.225 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -42.92 166.64 0.03 OUTLIER 'Trans proline' 0 N--CA 1.488 1.156 0 C-N-CA 122.079 1.853 . . . . 0.0 112.853 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -55.28 -50.43 13.0 Favored 'Trans proline' 0 N--CA 1.502 2.015 0 C-N-CA 122.522 2.148 . . . . 0.0 112.941 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -87.13 3.15 47.48 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.489 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.16 60.24 16.97 Favored Pre-proline 0 CA--C 1.531 0.212 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.044 178.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -80.12 144.26 16.55 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.608 2.205 . . . . 0.0 111.73 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.609 ' NH1' ' CD1' ' A' ' 52' ' ' PHE . 96.5 mtt-85 -133.36 131.39 40.02 Favored 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -114.36 103.96 11.59 Favored 'General case' 0 CA--C 1.508 -0.639 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.85 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -99.97 106.61 18.43 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.646 -0.422 . . . . 0.0 109.909 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.528 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 45.9 t -111.02 123.05 49.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.505 -179.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -106.47 150.55 25.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.002 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.5 p -119.76 119.74 61.23 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.201 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 96.5 m -93.96 122.12 36.14 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.375 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -143.0 131.99 22.94 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.473 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 49.9 t 46.14 46.7 13.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.933 0.397 . . . . 0.0 110.81 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.09 33.2 84.97 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.281 -0.727 . . . . 0.0 111.281 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.423 ' CG ' ' CE1' ' A' ' 47' ' ' PHE . 68.1 tp60 -139.28 125.17 19.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.826 0.346 . . . . 0.0 110.203 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.8 p -105.41 109.95 22.11 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.233 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.423 ' CE1' ' CG ' ' A' ' 45' ' ' GLN . 51.4 m-85 -90.77 140.88 29.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.165 -0.47 . . . . 0.0 109.782 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -148.51 149.4 31.58 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.175 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 42.5 t -88.69 162.12 16.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.642 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 96.4 p -87.67 -6.8 58.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.716 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -123.1 143.45 49.97 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.211 0.529 . . . . 0.0 110.781 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.609 ' CD1' ' NH1' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -91.7 142.62 27.41 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.891 -179.272 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.501 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -94.22 147.59 33.63 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 114.659 -1.155 . . . . 0.0 111.185 -179.568 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -76.15 -4.71 15.45 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 C-N-CA 122.69 2.26 . . . . 0.0 112.496 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.33 155.37 50.71 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.225 0.536 . . . . 0.0 111.132 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.03 -64.04 0.94 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.371 -178.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -54.64 -34.23 61.82 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 120.659 0.266 . . . . 0.0 110.575 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.6 t -55.79 -36.44 67.39 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.573 -0.451 . . . . 0.0 109.803 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.84 -41.19 71.79 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.5 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.529 ' OE1' ' NZ ' ' A' ' 6' ' ' LYS . 98.7 mt-10 -62.15 -43.06 99.68 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.874 -179.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.639 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -62.7 -51.38 67.41 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.208 0.528 . . . . 0.0 110.311 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.57 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -64.84 -35.24 80.47 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.176 -178.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.79 -49.39 77.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.594 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.7 -32.52 71.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.612 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -55.22 -45.75 75.96 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.619 0.247 . . . . 0.0 111.151 -179.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.3 pt -72.12 -37.45 59.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.62 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.85 -50.44 56.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.001 0.429 . . . . 0.0 111.961 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.96 -36.81 78.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.67 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.61 -26.96 68.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.755 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 37.5 m -78.49 -25.29 45.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.936 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.8 mt -119.43 29.01 7.85 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.28 0.562 . . . . 0.0 110.092 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 42.2 m . . . . . 0 C--N 1.322 -0.613 0 CA-C-O 117.904 -1.046 . . . . 0.0 110.534 179.309 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.6 mtm . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -69.04 140.75 54.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.443 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.516 ' O ' ' CG ' ' A' ' 3' ' ' HIS . 53.5 p-80 -77.71 69.99 4.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.918 -179.699 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.1 m -105.38 -13.93 9.09 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.121 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.924 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -60.13 -42.17 94.22 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.826 0.346 . . . . 0.0 110.867 -178.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.666 ' HZ2' ' CD2' ' A' ' 61' ' ' HIS . 64.3 mttp -60.87 -41.25 95.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.211 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.37 -31.62 81.47 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.736 -0.946 . . . . 0.0 110.736 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -75.94 -48.53 20.84 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.709 0.29 . . . . 0.0 111.459 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 48.2 tp -62.99 -39.42 94.66 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.305 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -63.06 -41.66 99.5 Favored 'General case' 0 N--CA 1.437 -1.105 0 C-N-CA 119.655 -0.818 . . . . 0.0 110.285 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.64 -40.25 84.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.895 179.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.42 ' O ' ' N ' ' A' ' 16' ' ' HIS . 53.8 t80 -61.98 -51.28 68.69 Favored 'General case' 0 N--CA 1.462 0.148 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.805 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.98 -40.4 73.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.433 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 39.1 tp -63.17 -46.21 88.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.529 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -79.61 -20.52 46.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.975 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.42 ' N ' ' O ' ' A' ' 12' ' ' TYR . 38.8 t-80 -87.15 -13.55 43.74 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.693 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 49.62 64.88 1.58 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.249 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -139.79 169.16 18.22 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.982 0.42 . . . . 0.0 110.452 179.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -46.36 126.08 7.54 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.739 178.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -45.81 151.42 0.85 Allowed Pre-proline 0 CA--C 1.539 0.542 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.669 -178.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.18 151.03 72.39 Favored 'Trans proline' 0 N--CA 1.499 1.802 0 C-N-CA 122.42 2.08 . . . . 0.0 112.215 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.4 t -133.51 131.08 57.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.227 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -106.14 152.13 23.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.885 179.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.485 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -114.56 146.01 41.27 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.1 178.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -124.42 124.56 42.6 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.788 0.328 . . . . 0.0 111.636 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -132.75 129.07 38.16 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 71.2 ttt-85 -134.3 120.36 19.84 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.355 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -162.18 135.1 5.96 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.496 -0.481 . . . . 0.0 109.843 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 145.02 163.42 10.08 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 120.316 -0.945 . . . . 0.0 112.185 178.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -54.03 159.82 6.96 Favored 'Trans proline' 0 N--CA 1.504 2.116 0 C-N-CA 122.571 2.181 . . . . 0.0 111.894 177.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -60.4 -42.39 41.68 Favored 'Trans proline' 0 N--CA 1.505 2.202 0 C-N-CA 122.863 2.375 . . . . 0.0 113.002 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -87.86 -2.05 58.36 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.206 0.527 . . . . 0.0 110.168 -179.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.79 62.28 17.17 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.583 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -78.42 142.62 18.81 Favored 'Trans proline' 0 C--N 1.304 -1.771 0 C-N-CA 122.622 2.215 . . . . 0.0 111.626 179.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -118.99 121.4 39.83 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -114.56 102.39 10.01 Favored 'General case' 0 CA--C 1.505 -0.787 0 C-N-CA 119.647 -0.821 . . . . 0.0 111.53 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.5 mtp85 -101.08 107.82 19.35 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.789 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.485 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 48.4 t -109.53 122.35 47.24 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.634 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.508 ' OD1' ' N ' ' A' ' 40' ' ' VAL . 40.8 t-20 -103.61 150.74 23.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.701 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.508 ' N ' ' OD1' ' A' ' 39' ' ' ASN . 4.0 p -122.42 119.6 58.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.866 0.365 . . . . 0.0 110.417 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 98.3 m -96.47 121.33 38.16 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.072 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -144.19 136.0 26.09 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.422 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 42.7 t 45.82 44.65 11.07 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.411 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.54 30.76 77.48 Favored Glycine 0 CA--C 1.526 0.776 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.921 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -135.48 131.06 35.64 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 122.691 -0.299 . . . . 0.0 110.314 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 54.4 p -108.8 107.4 17.81 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.047 0.451 . . . . 0.0 111.101 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -92.7 141.56 28.34 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.111 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -152.23 147.7 26.7 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.749 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.4 p -85.79 166.14 16.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.818 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 85.3 p -92.64 -6.96 48.28 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.626 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -122.7 129.51 51.89 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.006 0.432 . . . . 0.0 110.898 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -79.2 148.64 32.19 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.686 0.755 . . . . 0.0 110.17 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.485 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -96.22 150.33 37.05 Favored Pre-proline 0 C--N 1.313 -0.982 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.857 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -77.6 -4.41 14.57 Favored 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 122.421 2.081 . . . . 0.0 112.712 178.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.463 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -134.8 152.42 51.74 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 120.961 0.41 . . . . 0.0 110.851 -179.516 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.43 -62.44 1.53 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.762 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -56.11 -35.97 67.68 Favored 'General case' 0 CA--C 1.52 -0.198 0 O-C-N 122.137 -0.352 . . . . 0.0 110.816 -177.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.463 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 38.5 m -54.68 -36.12 64.3 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.1 -43.21 74.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.454 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.54 -41.86 97.97 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.463 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.666 ' CD2' ' HZ2' ' A' ' 6' ' ' LYS . 32.4 m170 -62.73 -48.81 77.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.766 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.05 -35.51 80.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.827 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.47 -48.88 79.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.478 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.86 -33.49 75.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -54.79 -46.91 74.51 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.656 0.265 . . . . 0.0 111.084 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.1 pt -73.97 -33.11 35.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.872 0.368 . . . . 0.0 110.663 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.443 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -67.33 -50.26 60.76 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.831 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.3 p -65.4 -30.11 49.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.527 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.41 -33.86 73.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.118 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.443 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 78.0 p -67.07 -39.67 86.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.019 0.438 . . . . 0.0 110.576 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 56.6 mt -66.79 -31.83 72.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.621 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 84.8 m . . . . . 0 C--O 1.219 -0.513 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.495 179.945 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.459 ' O ' ' N ' ' A' ' 3' ' ' HIS . 97.3 mmm . . . . . 0 N--CA 1.489 1.477 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 41.76 -94.3 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.9 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.551 ' O ' ' CG ' ' A' ' 3' ' ' HIS . 12.2 t-80 52.49 50.25 18.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.937 179.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -117.96 -44.64 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-O 120.966 0.412 . . . . 0.0 110.635 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.628 ' N ' ' CD1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -61.17 -23.83 65.85 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.859 -179.551 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -62.39 -42.39 99.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.154 0.502 . . . . 0.0 110.322 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.72 -23.55 76.44 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.086 -0.806 . . . . 0.0 111.086 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -78.04 -50.35 12.25 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.83 0.348 . . . . 0.0 111.179 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.5 tp -62.74 -42.59 99.74 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.14 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.9 tp-100 -64.45 -42.58 95.88 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.138 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.91 -37.27 78.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.824 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -61.52 -49.83 75.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.679 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.6 -47.3 84.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.934 0.397 . . . . 0.0 110.246 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.4 tp -62.15 -46.37 89.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.517 -179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -65.76 -38.7 89.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.976 0.417 . . . . 0.0 110.487 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.502 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 61.6 t-80 -87.51 -0.58 57.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.607 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 56.5 65.1 1.5 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.642 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 81.6 mt -127.71 151.7 48.65 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.678 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -46.86 128.0 10.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.131 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.441 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 10.0 mp -46.95 147.95 2.08 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.473 -178.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.06 152.57 62.7 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.369 2.046 . . . . 0.0 112.214 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 68.7 t -130.22 130.2 65.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.517 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -105.37 152.62 22.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.596 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.516 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -116.56 145.1 43.6 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.476 178.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -123.29 124.62 43.39 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.837 0.351 . . . . 0.0 111.234 -179.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -134.14 134.75 42.55 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.805 178.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -135.35 121.34 19.92 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.687 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -153.95 125.77 7.71 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 145.74 154.5 6.18 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -68.13 166.38 25.19 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.109 1.873 . . . . 0.0 111.846 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.87 -43.78 53.62 Favored 'Trans proline' 0 N--CA 1.503 2.047 0 C-N-CA 122.395 2.063 . . . . 0.0 113.059 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -78.97 -13.28 59.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.639 0.257 . . . . 0.0 111.129 -178.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.0 64.37 27.14 Favored Pre-proline 0 N--CA 1.467 0.409 0 CA-C-O 121.173 0.511 . . . . 0.0 110.807 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -82.07 141.5 11.79 Favored 'Trans proline' 0 C--N 1.312 -1.38 0 C-N-CA 122.462 2.108 . . . . 0.0 110.897 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -127.26 125.74 41.47 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -114.86 104.35 11.85 Favored 'General case' 0 CA--C 1.506 -0.737 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.789 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -101.76 107.25 18.4 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.065 0.46 . . . . 0.0 110.599 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.516 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 50.9 t -109.55 124.25 50.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.967 -179.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -105.24 149.95 25.55 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.3 p -119.7 119.32 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 120.913 0.387 . . . . 0.0 110.025 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 96.4 m -95.67 121.93 37.9 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.12 179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.482 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 5.3 t80 -143.07 137.38 29.15 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.36 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.483 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 12.0 p 42.19 42.83 2.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.829 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.484 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 66.16 32.35 82.01 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.436 -0.666 . . . . 0.0 111.436 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.484 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 97.7 mm-40 -136.46 130.87 33.25 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.66 0.266 . . . . 0.0 110.357 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 61.8 p -110.04 107.59 17.51 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.221 -179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.526 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 52.3 m-85 -94.14 141.06 28.97 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.966 179.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -154.26 148.03 25.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.481 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.6 p -85.31 168.21 14.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.464 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.9 p -93.83 -0.61 55.71 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.544 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -120.88 153.28 37.38 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.044 0.449 . . . . 0.0 110.344 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.686 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -103.94 134.69 46.81 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.813 -179.488 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.49 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -86.27 147.99 46.17 Favored Pre-proline 0 C--N 1.306 -1.318 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.579 -179.695 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.41 -4.63 15.28 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.704 2.269 . . . . 0.0 112.433 179.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -136.09 154.73 50.92 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.079 0.466 . . . . 0.0 111.22 -179.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.17 -62.62 1.43 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.312 -178.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.41 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 98.8 mttt -55.39 -34.46 64.37 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.756 0.312 . . . . 0.0 110.658 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 39.4 m -54.48 -35.94 63.61 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.454 -0.498 . . . . 0.0 109.925 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.17 -43.71 64.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.408 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -63.76 -44.27 93.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.645 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.41 ' CD2' ' O ' ' A' ' 57' ' ' LYS . 89.3 m-70 -64.04 -49.19 73.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.627 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.93 -35.2 79.96 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.611 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.15 -41.43 83.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.261 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.28 -34.59 78.34 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.625 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -53.87 -47.58 70.91 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.508 0.194 . . . . 0.0 110.907 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.8 pt -74.35 -27.93 22.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.583 179.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.58 -51.15 30.3 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.914 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.0 p -63.27 -30.67 50.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.425 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.9 -35.1 76.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.862 0.363 . . . . 0.0 110.794 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.526 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 17.7 m -62.03 -42.94 99.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.668 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.1 mt -66.69 -30.21 70.4 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.627 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 74.1 m . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.601 179.991 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.6 mtp . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -68.98 142.81 54.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.329 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -94.91 80.71 3.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.328 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 33.2 m -82.1 -16.18 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.859 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.667 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 3.2 m-85 -59.31 -44.21 92.58 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.759 -178.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -58.45 -43.53 88.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.413 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -72.79 -24.38 76.18 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 69.7 tp60 -77.13 -48.77 16.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.946 0.403 . . . . 0.0 111.087 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.8 tp -61.75 -41.45 97.7 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.291 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -62.85 -40.82 98.64 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.743 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.98 -38.18 79.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.553 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 86.0 t80 -62.0 -51.75 66.78 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.665 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.511 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -58.19 -46.22 86.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.416 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.6 tp -62.26 -47.2 85.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.729 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -66.19 -36.44 83.1 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.627 -179.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 61.8 m80 -92.05 -3.2 56.09 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.711 -179.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.511 ' N ' ' O ' ' A' ' 13' ' ' ALA . 97.4 m-20 56.76 66.01 1.27 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.698 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 70.1 mt -125.31 145.39 50.04 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.988 0.423 . . . . 0.0 110.48 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.585 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 1.3 pm0 -41.04 134.96 1.89 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.183 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.8 mt -47.31 143.37 5.17 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.973 -179.006 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -73.06 153.41 52.07 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 122.37 2.047 . . . . 0.0 111.989 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.4 t -129.65 130.62 66.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.413 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -107.02 153.01 23.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.718 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.515 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -115.47 146.39 41.7 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.326 178.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -123.97 124.16 41.98 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.062 0.458 . . . . 0.0 111.357 -179.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -134.86 129.34 34.27 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.0 ttt-85 -133.32 123.6 25.73 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.532 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.537 ' OE2' ' NH2' ' A' ' 37' ' ' ARG . 14.4 pt-20 -157.71 128.21 6.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.936 0.398 . . . . 0.0 109.996 179.344 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 143.34 161.37 8.82 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 111.234 -0.746 . . . . 0.0 111.234 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -68.83 163.2 38.27 Favored 'Trans proline' 0 C--N 1.306 -1.675 0 C-N-CA 122.405 2.07 . . . . 0.0 111.354 178.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.24 -37.73 97.05 Favored 'Trans proline' 0 C--N 1.308 -1.553 0 C-N-CA 122.992 2.462 . . . . 0.0 112.386 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -81.19 -14.74 57.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.845 0.355 . . . . 0.0 110.852 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.7 62.46 18.05 Favored Pre-proline 0 N--CA 1.47 0.549 0 CA-C-O 121.534 0.683 . . . . 0.0 110.961 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -78.27 143.14 19.59 Favored 'Trans proline' 0 C--N 1.302 -1.883 0 C-N-CA 122.115 1.877 . . . . 0.0 111.48 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 84.8 mtm-85 -124.32 122.24 37.17 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -114.23 104.05 11.7 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.949 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.537 ' NH2' ' OE2' ' A' ' 28' ' ' GLU . 87.7 mtm180 -102.87 105.84 16.3 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.515 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 52.6 t -109.21 124.55 51.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.398 -179.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -105.43 150.02 25.64 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.919 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.1 p -120.9 119.69 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 CA-C-O 121.036 0.446 . . . . 0.0 110.243 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 96.4 m -97.23 120.48 37.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.506 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.556 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 5.1 t80 -141.68 137.8 32.01 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.266 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.556 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 3.9 m 45.32 37.32 2.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.716 179.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.471 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 69.68 32.62 70.84 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 111.25 -0.74 . . . . 0.0 111.25 179.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.471 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 98.0 mm-40 -135.99 125.11 24.44 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 39.9 p -105.78 107.33 18.27 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.105 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -92.5 141.07 28.92 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.019 179.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 55.1 tt0 -150.49 152.3 34.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.325 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 73.2 m -95.42 160.56 14.47 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.532 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.8 m -87.2 -7.1 58.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.713 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.537 ' N ' ' OE1' ' A' ' 51' ' ' GLU . 56.3 mp0 -115.26 151.86 33.75 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.271 0.558 . . . . 0.0 110.237 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.691 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -103.53 133.7 48.12 Favored 'General case' 0 CA--C 1.505 -0.75 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.01 -179.219 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.46 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -86.19 147.16 44.28 Favored Pre-proline 0 C--N 1.308 -1.236 0 CA-C-N 114.118 -1.401 . . . . 0.0 110.831 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.84 -5.13 16.08 Favored 'Trans proline' 0 N--CA 1.498 1.756 0 C-N-CA 122.792 2.328 . . . . 0.0 112.581 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.471 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -135.07 155.42 50.77 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.141 0.496 . . . . 0.0 111.002 -179.379 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.68 -64.68 0.81 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.569 -178.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -53.11 -33.45 52.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.894 0.378 . . . . 0.0 110.657 -178.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.471 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 33.2 m -57.26 -35.05 69.26 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.047 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.3 -41.22 70.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.27 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -62.31 -40.25 95.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.38 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.667 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -64.66 -51.17 63.95 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.204 0.526 . . . . 0.0 110.501 179.74 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.549 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -65.71 -35.73 81.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.595 -178.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.91 -48.91 79.78 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.492 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.36 -32.91 73.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.733 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -54.93 -45.86 74.88 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.851 0.357 . . . . 0.0 111.34 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.2 pt -73.74 -33.51 38.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.986 0.422 . . . . 0.0 110.548 179.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.83 -50.0 47.02 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.125 0.488 . . . . 0.0 111.64 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.2 p -64.56 -31.11 52.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.407 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.43 ' O ' ' OG1' ' A' ' 72' ' ' THR . . . -69.51 -30.2 68.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.722 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.1 t -68.45 -42.64 78.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.805 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 53.3 mt -65.59 -30.56 71.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.715 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' ' 69' ' ' ALA . 21.4 p . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 117.976 -1.012 . . . . 0.0 110.845 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.539 ' SD ' ' N ' ' A' ' 1' ' ' MET . 2.3 mpt? . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -68.61 142.43 55.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.487 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.6 p-80 -151.53 35.52 0.56 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.516 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.4 m -85.68 -17.09 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.399 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -58.45 -44.15 89.12 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 120.805 0.336 . . . . 0.0 110.722 -179.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -58.98 -37.05 75.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.527 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.52 -26.26 59.47 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.1 mm-40 -78.66 -50.77 10.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.985 0.421 . . . . 0.0 111.091 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 35.7 tp -61.44 -42.78 99.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.582 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -63.15 -40.67 98.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.814 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.86 -37.35 79.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.385 179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -61.74 -50.01 74.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.769 -179.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.467 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.91 -47.71 79.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.942 0.401 . . . . 0.0 110.584 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.3 tp -61.6 -45.4 94.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.548 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -66.2 -41.81 89.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.649 -179.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.474 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 66.3 t-80 -86.52 -5.05 59.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.565 -179.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.467 ' N ' ' O ' ' A' ' 13' ' ' ALA . 44.4 t-20 60.49 65.83 1.01 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.584 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.7 mt -125.34 147.83 48.98 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.868 0.366 . . . . 0.0 110.393 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -45.41 134.37 6.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.033 0.444 . . . . 0.0 110.272 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.5 mt -46.06 143.85 3.27 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.739 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -73.0 155.44 52.8 Favored 'Trans proline' 0 C--N 1.309 -1.531 0 C-N-CA 122.733 2.289 . . . . 0.0 112.086 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.4 t -129.53 132.38 66.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.466 179.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -108.88 153.59 23.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.692 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.513 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -116.19 141.17 48.49 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.823 178.322 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -119.76 125.53 48.84 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.026 0.441 . . . . 0.0 110.966 -179.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -135.09 125.86 27.26 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.769 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -130.2 119.79 23.5 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.954 0.407 . . . . 0.0 110.388 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -159.57 133.05 7.13 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.184 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 146.04 149.86 5.08 Favored Glycine 0 CA--C 1.531 1.033 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -45.85 159.92 0.2 Allowed 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.661 2.241 . . . . 0.0 111.722 178.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -57.12 -44.17 46.39 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.743 2.295 . . . . 0.0 112.095 179.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.48 ' ND1' ' O ' ' A' ' 32' ' ' HIS . 64.1 t-80 -87.16 -0.61 56.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.203 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -141.13 61.65 14.65 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.917 178.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -81.17 145.9 15.55 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.776 2.317 . . . . 0.0 111.94 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -128.61 127.74 42.84 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.184 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -114.11 103.89 11.57 Favored 'General case' 0 C--O 1.216 -0.706 0 C-N-CA 120.338 -0.545 . . . . 0.0 111.162 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.658 HH21 ' NE2' ' A' ' 48' ' ' GLN . 79.5 mtp85 -104.94 104.95 14.8 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 53.7 t -110.08 128.3 55.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.42 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -108.29 152.36 24.73 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.128 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 p -121.06 120.46 62.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.074 0.464 . . . . 0.0 110.285 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 54.1 m -98.85 119.31 37.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.554 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -143.05 136.24 28.17 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.369 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.47 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 42.6 t 52.21 33.63 12.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.607 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 70.33 33.9 68.66 Favored Glycine 0 CA--C 1.522 0.488 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -139.09 125.4 20.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.836 0.35 . . . . 0.0 110.338 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 33.1 m -105.48 109.79 21.89 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.046 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -95.54 141.15 29.4 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.847 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.658 ' NE2' HH21 ' A' ' 37' ' ' ARG . 58.9 tt0 -144.58 147.96 33.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.933 0.397 . . . . 0.0 110.42 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.423 ' OG ' ' O ' ' A' ' 51' ' ' GLU . 9.3 p -84.63 161.83 19.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.523 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 91.5 p -88.61 -6.75 57.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.554 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.423 ' O ' ' OG ' ' A' ' 49' ' ' SER . 98.8 mt-10 -122.5 157.05 32.85 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.083 0.468 . . . . 0.0 110.355 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.69 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -105.01 139.22 40.02 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.613 0.721 . . . . 0.0 110.036 -179.271 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.466 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -91.4 147.77 36.12 Favored Pre-proline 0 C--N 1.308 -1.198 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.75 -179.668 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.81 -5.3 16.27 Favored 'Trans proline' 0 C--N 1.312 -1.388 0 C-N-CA 122.838 2.359 . . . . 0.0 112.4 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.433 ' O ' ' OG ' ' A' ' 58' ' ' SER . 44.1 m -132.61 155.78 48.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.266 0.555 . . . . 0.0 110.729 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.403 ' N ' ' CG2' ' A' ' 55' ' ' THR . 0.9 OUTLIER -69.86 -64.92 0.79 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.122 -178.676 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -52.02 -37.26 52.78 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.587 -177.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.433 ' OG ' ' O ' ' A' ' 55' ' ' THR . 78.0 p -55.0 -33.08 62.29 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 123.429 0.455 . . . . 0.0 110.382 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.47 -40.9 66.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.823 0.344 . . . . 0.0 110.925 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -64.47 -40.4 95.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.383 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -68.17 -46.08 71.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.752 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.92 -39.64 83.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.848 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.19 -48.95 79.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.728 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.32 -36.79 78.73 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.404 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -58.06 -47.7 82.36 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.433 HG21 HD13 ' A' ' 66' ' ' ILE . 86.3 mt -58.15 -47.32 87.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.318 -179.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.76 -44.94 76.31 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.587 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.5 t -58.54 -42.5 84.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.048 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.99 -25.97 68.37 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.539 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 6.3 t -67.49 -42.67 82.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.633 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 50.6 mt -68.42 -29.97 68.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.504 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.0 m . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.051 -0.976 . . . . 0.0 110.592 -179.74 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.613 ' H3 ' ' HG ' ' A' ' 58' ' ' SER . 4.3 ptt? . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.438 ' OD1' ' O ' ' A' ' 2' ' ' ASP . 44.4 p30 -64.13 144.85 56.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.465 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -139.12 -95.84 0.17 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.287 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.6 m -113.01 -21.91 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.895 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.655 ' CE2' ' ND1' ' A' ' 61' ' ' HIS . 17.6 m-85 -43.12 -64.79 0.57 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.88 0.371 . . . . 0.0 111.243 -179.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -50.83 -36.57 38.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.577 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -66.62 -36.69 91.72 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.916 -0.873 . . . . 0.0 110.916 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.8 tp60 -77.85 -49.2 14.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.988 0.423 . . . . 0.0 111.241 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 39.1 tp -60.06 -41.96 93.46 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.189 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -63.82 -41.93 97.76 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.912 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.45 -37.3 77.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.635 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.622 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 92.0 t80 -61.36 -53.56 55.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.982 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.436 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.47 -50.53 71.48 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.115 0.483 . . . . 0.0 110.653 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.52 -43.52 98.62 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.137 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -65.32 -39.26 92.21 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.584 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.622 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 60.3 m80 -89.72 -4.63 57.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.548 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.436 ' N ' ' O ' ' A' ' 13' ' ' ALA . 62.8 t30 62.36 67.13 0.74 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.521 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.3 mt -129.17 147.65 51.04 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 120.872 0.368 . . . . 0.0 110.642 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -44.18 137.52 3.41 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.192 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.9 mt -50.23 144.1 11.93 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.073 -179.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -70.64 151.53 64.13 Favored 'Trans proline' 0 C--N 1.312 -1.344 0 C-N-CA 122.322 2.015 . . . . 0.0 111.881 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 68.1 t -127.7 130.47 70.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.118 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -105.28 153.18 21.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.67 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.496 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -118.0 143.86 46.04 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.416 178.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -120.48 127.35 52.14 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.832 0.349 . . . . 0.0 111.207 -179.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -137.85 130.49 29.67 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.794 178.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -130.62 120.55 24.13 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.811 0.338 . . . . 0.0 110.452 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -158.76 132.51 7.57 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.203 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 148.79 143.71 3.83 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 120.6 -0.81 . . . . 0.0 111.458 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -44.1 165.5 0.04 OUTLIER 'Trans proline' 0 C--N 1.317 -1.124 0 C-N-CA 122.182 1.921 . . . . 0.0 112.431 179.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -54.22 -51.63 10.16 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.455 2.103 . . . . 0.0 112.643 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -86.07 4.27 38.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.465 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.36 61.32 19.7 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.922 179.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -81.87 142.74 12.74 Favored 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 122.602 2.201 . . . . 0.0 111.992 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 -131.39 129.64 41.56 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -114.07 103.4 11.09 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.167 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 90.9 mtm180 -99.73 106.48 18.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.15 0.5 . . . . 0.0 109.867 -179.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.496 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 45.0 t -110.63 122.29 47.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.358 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -105.24 152.78 22.45 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.839 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.0 p -121.48 120.1 60.89 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.282 0 CA-C-O 121.111 0.482 . . . . 0.0 110.246 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 94.8 m -95.18 121.69 37.08 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.107 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.422 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.1 t80 -140.73 136.25 32.36 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.803 0.335 . . . . 0.0 110.441 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 14.2 m 43.94 32.06 0.58 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.896 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.02 33.82 44.19 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.422 ' N ' ' O ' ' A' ' 42' ' ' PHE . 86.5 mt-30 -136.69 122.97 20.56 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 29.8 p -103.32 108.23 19.38 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.895 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -90.97 140.28 29.98 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.768 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -143.12 144.64 32.3 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.426 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.721 ' HG ' ' H ' ' A' ' 51' ' ' GLU . 39.3 t -87.4 159.97 18.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.493 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 86.4 p -89.7 -5.82 56.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.682 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.721 ' H ' ' HG ' ' A' ' 49' ' ' SER . 97.4 mt-10 -117.81 153.26 33.78 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.18 0.514 . . . . 0.0 110.052 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.67 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -103.46 133.21 48.89 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-O 121.856 0.836 . . . . 0.0 109.917 -179.289 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.428 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -87.64 145.93 38.18 Favored Pre-proline 0 C--N 1.311 -1.099 0 CA-C-N 114.045 -1.434 . . . . 0.0 110.748 179.879 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -76.38 -5.46 16.18 Favored 'Trans proline' 0 N--CA 1.496 1.623 0 C-N-CA 122.735 2.29 . . . . 0.0 112.433 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.48 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 1.1 p -136.21 155.89 49.47 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.027 0.441 . . . . 0.0 110.9 -179.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.15 -64.18 0.91 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.108 -178.656 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -52.7 -34.16 50.88 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.536 -177.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.613 ' HG ' ' H3 ' ' A' ' 1' ' ' MET . 21.6 m -56.48 -36.02 68.64 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.274 179.416 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.42 -38.4 71.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.03 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.33 -43.94 96.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.526 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.655 ' ND1' ' CE2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -61.71 -50.23 73.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.171 0.51 . . . . 0.0 110.588 179.826 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.58 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -66.82 -36.06 81.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.632 -179.134 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.72 -47.95 82.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.685 -179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.39 -32.51 72.62 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.594 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -58.79 -53.89 53.3 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.07 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.6 pt -58.6 -44.6 89.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.44 -179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.7 -45.03 76.3 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.984 0.421 . . . . 0.0 110.402 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.1 t -60.35 -42.56 91.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.65 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.08 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.2 -27.45 68.99 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.458 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.3 m -71.43 -33.86 69.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.514 179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 11.2 mt -112.92 29.51 7.91 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.149 0.5 . . . . 0.0 109.787 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.3 m . . . . . 0 C--N 1.322 -0.619 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.435 179.293 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.6 ptp . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -67.68 139.64 56.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.615 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.508 ' O ' ' CD2' ' A' ' 3' ' ' HIS . 52.3 p-80 -75.48 65.37 1.72 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.722 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.8 m -111.8 -22.73 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-O 120.7 0.286 . . . . 0.0 110.709 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -60.66 -40.97 94.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.878 0.37 . . . . 0.0 110.607 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -58.74 -40.5 84.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.544 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -70.77 -25.44 75.72 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 96.4 mm-40 -77.35 -48.62 16.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.193 0.52 . . . . 0.0 111.297 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 44.7 tp -62.55 -42.08 99.31 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.367 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -64.07 -42.25 97.06 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.724 -179.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.03 -36.82 78.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.374 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.605 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 91.2 t80 -61.73 -51.07 69.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.794 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.506 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -57.58 -48.02 80.53 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.01 0.433 . . . . 0.0 110.369 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.1 tp -62.74 -44.77 95.34 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.529 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -64.98 -38.97 92.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.689 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.605 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 64.6 m80 -93.09 -1.23 56.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.614 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.506 ' N ' ' O ' ' A' ' 13' ' ' ALA . 11.9 m120 55.92 65.29 1.48 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.532 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.2 mt -122.02 149.49 43.43 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.03 0.443 . . . . 0.0 110.326 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.437 ' OE1' ' N ' ' A' ' 19' ' ' GLU . 55.6 mp0 -41.3 151.54 0.07 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.579 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.475 ' CD2' ' N ' ' A' ' 20' ' ' LEU . 3.5 mm? -61.54 137.74 94.86 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.914 -178.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.28 154.54 56.46 Favored 'Trans proline' 0 C--N 1.317 -1.101 0 C-N-CA 122.069 1.846 . . . . 0.0 112.004 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 68.6 t -133.17 134.87 57.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.537 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -111.88 152.1 28.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.898 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -109.84 144.78 37.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.079 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -127.08 120.34 28.72 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.915 0.388 . . . . 0.0 111.354 -179.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -133.45 127.66 33.8 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -131.18 119.23 21.57 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 120.719 0.295 . . . . 0.0 110.378 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -159.67 134.78 8.1 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 120.45 -0.5 . . . . 0.0 109.812 179.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 147.44 147.67 4.59 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 120.468 -0.872 . . . . 0.0 111.559 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -45.19 160.92 0.11 Allowed 'Trans proline' 0 N--CA 1.491 1.377 0 C-N-CA 122.389 2.06 . . . . 0.0 111.74 178.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -57.02 -43.42 54.05 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 122.864 2.376 . . . . 0.0 111.952 179.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -88.43 0.49 56.18 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.319 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.32 60.52 14.57 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.901 179.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -78.54 143.03 18.84 Favored 'Trans proline' 0 C--N 1.307 -1.632 0 C-N-CA 122.443 2.095 . . . . 0.0 112.048 179.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 87.9 mtm-85 -129.64 127.36 40.43 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -114.51 103.83 11.42 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 120.146 -0.622 . . . . 0.0 110.977 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.494 HH12 ' C ' ' A' ' 50' ' ' SER . 33.7 mmt180 -104.38 105.29 15.36 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.29 0.566 . . . . 0.0 110.03 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 74.1 m -114.23 134.18 55.1 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.309 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.43 ' OD1' ' OE1' ' A' ' 48' ' ' GLN . 59.6 m-20 -110.14 157.89 18.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.353 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 p -122.42 120.75 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-O 121.202 0.525 . . . . 0.0 110.108 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 52.0 m -102.73 119.86 39.57 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.439 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.516 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.4 t80 -143.91 138.54 28.62 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.183 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.451 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 48.7 t 42.62 32.77 0.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.811 0.338 . . . . 0.0 110.909 179.774 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.27 30.27 59.0 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.516 ' N ' ' O ' ' A' ' 42' ' ' PHE . 99.1 mm-40 -125.19 119.23 27.95 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.817 0.342 . . . . 0.0 110.245 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 26.3 p -109.78 100.73 9.69 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.555 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -107.85 143.24 36.72 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.417 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.43 ' OE1' ' OD1' ' A' ' 39' ' ' ASN . 18.0 pt20 -153.52 154.04 33.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.772 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.3 p -82.35 162.21 22.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.403 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.494 ' C ' HH12 ' A' ' 37' ' ' ARG . 91.2 p -92.11 -3.11 56.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.577 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -109.77 153.28 24.57 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.239 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.629 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 1.0 OUTLIER -102.23 122.85 45.0 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 121.735 0.779 . . . . 0.0 109.923 -179.228 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.488 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.6 OUTLIER -78.34 148.98 75.05 Favored Pre-proline 0 C--N 1.306 -1.303 0 CA-C-N 114.144 -1.389 . . . . 0.0 110.748 -179.847 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -77.72 -6.48 16.12 Favored 'Trans proline' 0 N--CA 1.493 1.466 0 C-N-CA 122.628 2.218 . . . . 0.0 112.35 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.458 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -136.11 153.52 51.28 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.981 0.42 . . . . 0.0 110.384 -179.308 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.64 -60.32 3.48 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.007 -179.231 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -55.02 -34.09 63.19 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.927 -177.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.458 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 37.9 m -57.13 -35.88 70.01 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.206 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.53 -47.81 52.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.813 0.339 . . . . 0.0 111.283 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -62.56 -42.1 99.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.356 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -66.32 -45.74 79.27 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.683 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.45 -38.35 84.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.714 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.72 -48.0 82.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.552 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.4 -38.69 77.86 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.402 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -55.12 -43.21 73.88 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.007 0.432 . . . . 0.0 110.107 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 62.4 mt -68.13 -42.95 85.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.439 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.437 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -65.48 -49.31 69.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.032 0.444 . . . . 0.0 111.657 -178.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.8 p -67.25 -29.02 44.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.369 -179.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.8 -27.42 62.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.825 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 83.6 p -73.77 -38.31 64.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.051 0.453 . . . . 0.0 110.522 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 63.7 mt -67.2 -30.63 70.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.617 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 20.7 p . . . . . 0 C--N 1.325 -0.488 0 CA-C-O 117.958 -1.02 . . . . 0.0 110.782 -179.894 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.2 mtp . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -61.84 -43.59 98.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.517 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 73.1 m80 39.08 42.37 0.69 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.088 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 15.3 m -83.77 -16.38 11.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.991 179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.659 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 4.3 m-85 -61.27 -42.54 98.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.738 -179.221 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -59.35 -42.66 92.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.372 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.44 -24.29 63.43 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 111.229 -0.748 . . . . 0.0 111.229 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -76.92 -48.61 17.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.0 0.428 . . . . 0.0 110.938 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 33.6 tp -62.95 -41.52 99.53 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.09 -179.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -62.01 -41.75 98.4 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 119.701 -0.8 . . . . 0.0 110.614 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.61 -36.4 80.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.631 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.621 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 76.2 t80 -61.25 -51.18 70.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.596 -179.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.76 -48.96 76.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.084 0.468 . . . . 0.0 110.23 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.1 tp -62.68 -43.81 97.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.462 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -64.0 -40.31 96.08 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.626 -179.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 62.8 m80 -90.56 -4.94 56.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.63 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.476 ' N ' ' O ' ' A' ' 13' ' ' ALA . 63.3 t30 62.98 66.62 0.73 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.611 179.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.7 mt -127.67 148.3 50.39 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.457 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -45.78 136.94 5.8 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.932 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.0 mt -47.31 143.89 4.81 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.993 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -72.66 155.92 53.91 Favored 'Trans proline' 0 N--CA 1.494 1.509 0 C-N-CA 122.465 2.11 . . . . 0.0 112.016 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 74.9 t -129.58 130.34 67.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.445 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -106.55 152.4 23.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.333 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.506 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -113.68 145.86 40.69 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.388 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -125.02 121.96 35.89 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.742 0.306 . . . . 0.0 111.146 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -131.77 129.4 40.52 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 177.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.6 ttt-85 -130.84 118.55 20.94 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -158.34 134.05 8.97 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.532 -0.467 . . . . 0.0 109.894 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.04 142.96 3.69 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 120.219 -0.991 . . . . 0.0 111.536 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -43.88 164.94 0.04 OUTLIER 'Trans proline' 0 N--CA 1.488 1.206 0 C-N-CA 121.766 1.644 . . . . 0.0 112.392 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.6 -48.28 22.71 Favored 'Trans proline' 0 N--CA 1.499 1.848 0 C-N-CA 122.424 2.083 . . . . 0.0 112.715 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -88.97 4.88 46.63 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.579 -179.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.35 61.05 18.55 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.838 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -80.05 141.52 14.85 Favored 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.471 2.114 . . . . 0.0 111.65 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -131.0 129.37 41.99 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 178.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -114.89 104.15 11.64 Favored 'General case' 0 CA--C 1.508 -0.642 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.187 179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.8 mtp180 -100.52 105.94 17.43 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.674 -0.41 . . . . 0.0 109.9 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.506 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 44.1 t -110.63 125.26 53.24 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 120.96 0.41 . . . . 0.0 110.37 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -108.02 155.62 20.15 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.152 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.3 p -123.27 120.04 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.086 0.47 . . . . 0.0 110.347 -179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 95.4 m -97.92 119.27 36.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.233 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.524 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 5.3 t80 -140.07 139.44 35.9 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.337 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.524 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 6.2 m 44.11 32.25 0.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.6 32.32 54.67 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.496 -0.642 . . . . 0.0 111.496 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 42' ' ' PHE . 84.7 mt-30 -134.75 120.69 19.74 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.766 0.317 . . . . 0.0 110.253 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.2 m -102.72 107.68 18.65 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 121.02 0.438 . . . . 0.0 110.885 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -91.16 141.12 29.15 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.157 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -142.71 139.11 30.99 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.522 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.9 p -81.77 162.69 22.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.436 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.9 m -90.63 -9.24 47.69 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.732 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -120.99 142.37 49.85 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.266 0.555 . . . . 0.0 110.602 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.573 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.0 140.19 29.9 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.956 -179.368 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.411 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -92.33 147.93 35.49 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 114.711 -1.131 . . . . 0.0 111.12 -179.701 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -77.03 -4.61 15.07 Favored 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 122.807 2.338 . . . . 0.0 112.582 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.02 154.29 51.24 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.243 0.544 . . . . 0.0 111.143 -179.194 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.67 -64.86 0.78 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.632 -178.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -56.1 -35.45 67.04 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 120.731 0.301 . . . . 0.0 110.567 -177.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 40.2 t -56.45 -34.19 66.62 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.986 179.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.88 -39.46 79.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.27 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -62.43 -41.73 98.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.6 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.659 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -62.01 -52.17 65.06 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.162 0.506 . . . . 0.0 110.446 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.567 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -64.97 -37.24 86.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.743 -178.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.59 -45.46 91.81 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.437 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.16 -34.09 75.67 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.906 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -59.35 -52.8 64.08 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 121.092 -0.243 . . . . 0.0 111.421 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.4 pt -57.82 -45.57 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.124 -179.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.88 -43.36 83.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.083 0.468 . . . . 0.0 110.659 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.4 t -60.6 -42.71 92.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.064 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.67 -27.72 69.42 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.696 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.4 m -67.56 -40.98 84.93 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.818 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 57.6 mt -66.77 -30.62 70.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.481 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 21.7 m . . . . . 0 C--N 1.325 -0.46 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.76 179.959 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 39.8 ttm . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -77.07 153.03 34.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.654 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.621 ' ND1' ' CE1' ' A' ' 61' ' ' HIS . 85.9 t60 55.54 50.66 14.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.009 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.8 m -109.76 -11.58 11.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 121.013 0.435 . . . . 0.0 110.738 179.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -60.91 -44.52 97.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.653 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -59.83 -42.55 93.8 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.598 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.47 -34.92 91.2 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -74.99 -44.51 47.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.063 0.459 . . . . 0.0 111.053 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 49.1 tp -62.97 -40.79 98.78 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.199 -179.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -66.29 -40.06 89.8 Favored 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 119.901 -0.72 . . . . 0.0 110.785 -179.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.28 -40.15 89.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.449 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -62.91 -48.18 80.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.67 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.71 -40.27 62.84 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.381 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.413 ' O ' ' ND2' ' A' ' 17' ' ' ASN . 49.3 tp -63.49 -44.84 93.2 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.429 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.6 tp60 -70.29 -41.01 73.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.989 0.424 . . . . 0.0 111.122 -178.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.463 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 58.7 t-80 -74.0 -14.0 60.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.608 -179.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.413 ' ND2' ' O ' ' A' ' 14' ' ' LEU . 20.8 m120 54.83 69.0 0.78 Allowed 'General case' 0 C--O 1.233 0.198 0 C-N-CA 120.886 -0.325 . . . . 0.0 111.762 178.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -147.07 169.45 19.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.316 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -43.37 131.37 4.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.183 178.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.9 mp -53.94 152.35 10.54 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.717 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -66.82 148.61 82.77 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 C-N-CA 122.447 2.098 . . . . 0.0 112.085 179.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 75.0 t -132.84 132.2 59.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.561 179.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 32.1 m-85 -107.99 151.32 25.98 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.468 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -126.16 131.96 51.92 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -112.65 137.61 50.67 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.854 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -139.84 150.39 44.61 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.6 ttt-85 -120.84 127.41 51.89 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -162.78 105.95 1.07 Allowed 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.894 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 167.3 -175.12 42.47 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 120.285 -0.959 . . . . 0.0 111.028 -179.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -45.06 155.7 0.31 Allowed 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.54 2.16 . . . . 0.0 111.599 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.31 -57.47 0.26 Allowed 'Trans proline' 0 N--CA 1.5 1.885 0 C-N-CA 122.504 2.136 . . . . 0.0 112.678 -179.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.46 ' O ' ' CG ' ' A' ' 32' ' ' HIS . 83.2 t60 -84.87 -6.48 59.35 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.465 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -144.01 62.56 10.62 Favored Pre-proline 0 CA--C 1.531 0.243 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -75.03 157.83 42.44 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 C-N-CA 122.771 2.314 . . . . 0.0 112.578 -179.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -104.27 145.92 29.54 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -112.49 105.17 13.34 Favored 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 120.565 -0.454 . . . . 0.0 111.648 -178.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 -101.4 108.65 20.31 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.406 ' C ' HD21 ' A' ' 39' ' ' ASN . 62.0 m -115.01 143.67 44.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.921 0.391 . . . . 0.0 110.633 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.527 ' OD1' ' NE2' ' A' ' 48' ' ' GLN . 3.0 m120 -116.36 157.52 24.91 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.949 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.7 p -124.31 121.06 60.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.928 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 64.7 m -96.37 124.67 40.45 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.622 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.478 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.1 t80 -146.35 139.64 25.8 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.238 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.495 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 42.9 t 42.99 32.79 0.45 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.915 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 74.98 28.06 63.26 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 42' ' ' PHE . 87.0 mt-30 -131.32 130.85 43.27 Favored 'General case' 0 C--O 1.233 0.211 0 O-C-N 122.724 -0.28 . . . . 0.0 110.42 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 63.6 p -108.76 104.63 13.95 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.968 0.414 . . . . 0.0 110.879 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -89.83 140.68 29.37 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.964 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.527 ' NE2' ' OD1' ' A' ' 39' ' ' ASN . 87.8 mt-30 -141.01 154.77 46.16 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.313 -179.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 42.8 m -100.45 157.78 16.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.52 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.9 t -89.53 -2.6 58.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.718 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -116.85 136.34 53.03 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.268 0.556 . . . . 0.0 110.308 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.579 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.68 144.95 24.81 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.71 -179.578 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.55 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -105.97 148.05 35.86 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 114.623 -1.171 . . . . 0.0 111.085 179.783 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.87 -3.54 13.61 Favored 'Trans proline' 0 N--CA 1.5 1.891 0 C-N-CA 122.938 2.425 . . . . 0.0 112.64 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 89.3 m -134.88 154.24 51.74 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.04 0.447 . . . . 0.0 111.24 -179.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.19 -62.98 1.22 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.506 -178.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.473 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 98.5 mttt -54.1 -33.57 58.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.738 0.304 . . . . 0.0 110.593 -177.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.5 m -56.95 -34.71 68.29 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.434 -0.507 . . . . 0.0 110.032 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -73.1 -44.28 60.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.45 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.25 -41.92 94.23 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.741 -179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.621 ' CE1' ' ND1' ' A' ' 3' ' ' HIS . 0.3 OUTLIER -61.81 -49.67 75.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.662 -179.727 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.51 -33.75 74.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.84 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.13 -49.19 77.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.825 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.67 -31.29 70.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.625 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -54.68 -46.21 74.03 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 121.124 -0.23 . . . . 0.0 110.75 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 23.3 pt -74.92 -30.88 24.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.817 0.341 . . . . 0.0 110.654 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.436 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -70.94 -52.07 22.08 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.125 0.488 . . . . 0.0 111.672 -179.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.1 p -61.71 -31.02 49.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.355 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.04 -28.64 64.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.731 179.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.436 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 78.0 p -69.27 -39.31 78.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.734 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 42.5 mt -68.26 -30.93 70.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.511 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 22.1 p . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 118.161 -0.924 . . . . 0.0 110.782 -179.934 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.2 mtp . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -90.64 114.21 26.44 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.391 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.626 ' CG ' ' CE1' ' A' ' 61' ' ' HIS . 2.7 m-70 -69.12 73.85 0.31 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.532 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.0 m -95.64 -16.33 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 CA-C-N 116.561 -0.291 . . . . 0.0 110.742 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -56.22 -45.76 79.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.848 0.356 . . . . 0.0 111.067 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -59.99 -41.57 92.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.579 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.84 -30.79 72.49 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.48 -0.648 . . . . 0.0 111.48 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 -76.81 -48.91 17.12 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.213 0.53 . . . . 0.0 110.631 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.2 tp -61.97 -42.59 99.31 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.507 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.2 tp60 -65.29 -40.93 94.46 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.531 -179.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.76 -39.29 76.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.807 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.467 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 90.3 t80 -61.86 -49.93 74.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.151 -179.376 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.89 -52.25 64.73 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.19 0.519 . . . . 0.0 110.592 -179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.68 -42.93 97.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.828 -179.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -53.71 -39.42 65.2 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.67 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.467 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 77.7 m80 -97.79 2.75 49.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.587 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 62.3 t30 64.54 67.37 0.57 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.022 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.5 mp -115.21 -172.97 2.23 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.545 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -91.77 139.77 30.35 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.941 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.445 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 10.2 mp -47.53 141.9 6.7 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.03 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.98 158.19 42.42 Favored 'Trans proline' 0 N--CA 1.495 1.578 0 C-N-CA 122.87 2.38 . . . . 0.0 111.824 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.6 t -129.96 134.65 62.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.547 179.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -114.24 154.64 27.57 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.238 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -118.67 144.51 46.15 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.0 178.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -123.86 125.38 44.56 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.254 0.55 . . . . 0.0 111.162 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -134.39 127.75 32.23 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -128.87 120.37 26.11 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.187 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -158.55 132.42 7.72 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.51 140.74 3.31 Favored Glycine 0 CA--C 1.534 1.233 0 C-N-CA 120.493 -0.86 . . . . 0.0 111.072 179.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -43.44 167.14 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.417 2.078 . . . . 0.0 112.92 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.06 -50.56 13.19 Favored 'Trans proline' 0 N--CA 1.5 1.856 0 C-N-CA 122.883 2.388 . . . . 0.0 113.059 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 15.8 p80 -89.42 4.52 48.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.696 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.66 61.52 19.5 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.813 179.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -81.87 143.16 12.96 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.624 2.216 . . . . 0.0 112.043 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -132.35 128.93 38.7 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -113.86 104.16 11.91 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.756 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -103.58 105.82 16.16 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.108 0.48 . . . . 0.0 109.978 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 69.4 m -115.28 133.39 56.08 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.119 0.485 . . . . 0.0 111.26 -179.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.415 ' OD1' ' NE2' ' A' ' 48' ' ' GLN . 97.7 m-20 -110.27 153.36 24.95 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.522 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.2 p -120.48 119.83 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.316 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.6 m -97.32 119.64 36.21 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.377 179.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -143.18 139.63 30.41 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.462 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.423 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 49.5 t 47.98 32.28 2.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.842 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.99 31.38 61.98 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -137.43 132.68 33.76 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 40.9 p -108.71 107.01 17.3 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.032 -179.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -93.1 140.88 29.03 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.885 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.415 ' NE2' ' OD1' ' A' ' 39' ' ' ASN . 57.2 tt0 -151.5 146.9 26.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.337 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.0 p -85.57 164.31 17.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.695 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.0 p -90.24 -2.02 57.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.833 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -124.45 143.19 50.77 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.407 0.623 . . . . 0.0 110.808 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.644 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -91.45 143.14 26.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.54 -179.33 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.513 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -96.2 149.29 35.73 Favored Pre-proline 0 C--N 1.318 -0.8 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.132 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -77.23 -3.59 13.86 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 123.182 2.588 . . . . 0.0 112.752 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.443 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 0.8 OUTLIER -134.31 155.9 49.41 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.238 0.542 . . . . 0.0 110.757 -179.508 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.4 -66.01 0.65 Allowed 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.493 -178.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -53.22 -34.19 56.01 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.603 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.443 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 77.4 p -57.63 -33.27 68.09 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.579 179.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.11 -40.87 71.22 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.941 0.401 . . . . 0.0 110.888 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -65.37 -40.32 93.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.402 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.626 ' CE1' ' CG ' ' A' ' 3' ' ' HIS . 27.7 m170 -62.98 -50.31 71.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.749 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.25 -34.46 78.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.761 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.32 -46.35 86.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.598 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.77 -33.67 75.29 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.823 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 53.9 tttp -54.11 -46.03 72.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.587 0.232 . . . . 0.0 110.845 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.2 pt -74.84 -29.55 22.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.679 179.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.89 -51.49 25.88 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.471 -179.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.0 p -63.36 -29.01 46.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.281 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.82 -31.22 67.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 0.0 110.68 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 37.1 t -66.29 -42.92 87.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.675 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 52.3 mt -66.11 -30.19 70.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.696 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 29.3 m . . . . . 0 C--O 1.22 -0.475 0 CA-C-O 118.095 -0.955 . . . . 0.0 110.406 -179.885 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.9 ptm . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' A' ' 2' ' ' ASP . 63.9 t0 -62.06 -39.72 93.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.557 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.1 m170 45.11 85.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.452 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 31.3 m -89.79 -18.63 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-O 120.863 0.363 . . . . 0.0 110.756 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.523 ' CE1' ' NE2' ' A' ' 61' ' ' HIS . 4.4 m-85 -53.58 -45.02 69.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.792 -179.103 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -62.12 -41.09 97.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.637 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.48 -30.36 56.7 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.249 -0.741 . . . . 0.0 111.249 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -75.63 -47.32 26.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.808 0.337 . . . . 0.0 111.106 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 35.0 tp -61.56 -43.13 99.43 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.385 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -64.25 -41.52 96.92 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.836 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.06 -36.96 78.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.584 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.631 ' CE2' ' CE1' ' A' ' 16' ' ' HIS . 50.0 t80 -59.73 -50.69 72.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.823 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.4 -48.34 77.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.489 179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 47.7 tp -62.02 -43.71 98.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.611 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -63.69 -39.3 93.98 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.712 -179.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.631 ' CE1' ' CE2' ' A' ' 12' ' ' TYR . 57.8 m80 -89.36 2.48 54.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.549 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 61.6 t30 60.0 61.66 1.83 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.526 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.8 mt -131.2 148.52 52.71 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.599 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -48.29 134.67 14.48 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.016 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.449 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 10.1 mp -48.51 150.02 2.6 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.858 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.92 152.57 63.43 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 C-N-CA 122.587 2.191 . . . . 0.0 111.934 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 79.6 t -129.2 128.76 67.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.415 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -104.82 152.49 22.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.402 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.532 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -126.0 132.68 51.97 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.207 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.482 ' ND2' ' SG ' ' A' ' 38' ' ' CYS . 8.3 m120 -110.39 136.44 49.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.956 0.407 . . . . 0.0 110.882 -178.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -139.74 149.69 43.91 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.022 179.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -124.78 129.45 50.48 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.7 tm-20 -165.01 108.45 0.86 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.114 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 165.94 -173.16 41.51 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.044 -0.823 . . . . 0.0 111.044 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.448 ' O ' ' N ' ' A' ' 34' ' ' PRO . 76.5 Cg_exo -45.64 130.05 11.95 Favored 'Trans proline' 0 C--N 1.309 -1.541 0 C-N-CA 122.698 2.265 . . . . 0.0 111.798 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_exo -46.12 -56.96 2.48 Favored 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 122.276 1.984 . . . . 0.0 113.099 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -78.34 -11.8 59.96 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.74 -179.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -144.66 67.4 14.1 Favored Pre-proline 0 CA--C 1.541 0.598 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.448 ' N ' ' O ' ' A' ' 30' ' ' PRO . 64.0 Cg_endo -77.82 156.6 31.16 Favored 'Trans proline' 0 C--N 1.3 -1.989 0 C-N-CA 122.608 2.206 . . . . 0.0 112.766 -178.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -101.26 145.35 28.96 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -111.49 106.84 15.85 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-O 121.203 0.525 . . . . 0.0 111.938 -179.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -100.28 108.28 20.3 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.532 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 35.3 t -111.74 134.5 53.27 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.834 -179.169 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -112.54 157.58 20.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.225 179.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.9 p -122.49 120.57 61.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-O 120.87 0.367 . . . . 0.0 110.277 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 93.8 m -95.66 121.17 37.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.562 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -144.1 132.28 21.8 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.019 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.476 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 44.9 t 49.43 32.21 4.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.904 0.383 . . . . 0.0 110.878 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.03 31.54 57.65 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 111.467 -0.653 . . . . 0.0 111.467 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -134.31 128.86 34.6 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 76.2 p -107.73 106.87 17.38 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.027 -179.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -92.82 142.23 27.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.122 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -138.39 160.08 40.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.376 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.9 t -100.32 161.12 13.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.437 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.0 p -90.99 -5.94 54.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.562 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.545 ' N ' ' OE1' ' A' ' 51' ' ' GLU . 55.9 mp0 -117.72 139.89 50.41 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.114 0.483 . . . . 0.0 110.495 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.576 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.62 145.32 24.91 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.919 -179.166 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.524 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -107.9 147.19 34.99 Favored Pre-proline 0 C--N 1.315 -0.913 0 CA-C-N 115.014 -0.993 . . . . 0.0 111.065 179.763 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -77.91 -3.41 13.48 Favored 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 122.736 2.291 . . . . 0.0 112.555 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.476 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 1.2 p -134.26 153.98 51.55 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.007 0.432 . . . . 0.0 111.064 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.17 -63.76 1.01 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.275 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -52.31 -34.41 46.8 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.995 -177.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.476 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 34.6 m -57.55 -33.39 68.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.856 0.36 . . . . 0.0 110.527 179.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.74 -46.22 54.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.164 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -59.04 -34.93 72.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.432 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.523 ' NE2' ' CE1' ' A' ' 5' ' ' TYR . 2.7 t-80 -62.31 -60.01 4.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.872 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.406 ' N ' ' ND1' ' A' ' 61' ' ' HIS . . . -64.91 -34.92 79.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.772 -179.365 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.98 -52.6 65.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.955 -179.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.58 -39.58 80.74 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.81 -179.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -57.18 -48.71 78.07 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.668 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.437 HG21 HD13 ' A' ' 66' ' ' ILE . 96.7 mt -56.82 -46.99 83.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.304 -179.278 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.94 -45.8 73.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.025 0.44 . . . . 0.0 110.431 179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.0 t -57.04 -41.25 77.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.004 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -66.49 -27.24 67.63 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.827 0.346 . . . . 0.0 110.675 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.4 m -67.77 -40.15 84.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.734 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 49.9 mt -67.91 -30.08 69.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.429 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.1 t . . . . . 0 C--O 1.219 -0.534 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.686 -179.561 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.0 mtt . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -88.86 110.25 20.9 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.469 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 75.6 t60 -74.78 69.76 1.84 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.669 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.5 m -104.25 -13.89 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 CA-C-O 120.784 0.326 . . . . 0.0 110.855 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.657 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 5.7 m-85 -58.24 -45.58 87.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.717 -179.185 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -59.43 -41.98 90.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.969 0.414 . . . . 0.0 110.253 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.57 -32.54 83.59 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -76.51 -47.38 22.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.007 0.432 . . . . 0.0 111.158 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.8 tp -62.2 -42.55 99.4 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.303 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -62.61 -41.4 98.97 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 119.692 -0.803 . . . . 0.0 110.691 -178.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.42 -37.39 82.98 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.572 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.617 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 63.0 t80 -61.32 -50.96 70.87 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.669 -179.497 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.77 -47.28 80.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.971 0.415 . . . . 0.0 110.266 -179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.5 tp -62.16 -45.38 93.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.503 -179.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -65.01 -38.18 90.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.506 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.617 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 62.4 m80 -91.17 2.28 56.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.536 -179.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 54.53 65.04 1.61 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.686 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.5 mt -127.65 151.32 49.09 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.089 0.471 . . . . 0.0 110.567 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -47.68 139.26 7.4 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.845 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 pp -52.68 146.19 18.82 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.902 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -72.35 153.24 55.92 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 122.5 2.133 . . . . 0.0 112.119 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.5 t -129.79 131.21 66.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.523 179.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -106.99 152.41 24.02 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.34 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -128.18 110.72 12.7 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 178.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.448 ' OD1' ' O ' ' A' ' 25' ' ' ASN . 40.7 p30 -107.3 144.14 34.56 Favored 'General case' 0 CA--C 1.517 -0.302 0 O-C-N 123.713 0.633 . . . . 0.0 110.987 -178.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.451 ' OE1' ' N ' ' A' ' 27' ' ' ARG . 0.7 OUTLIER -145.04 148.63 33.91 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.252 178.786 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.451 ' N ' ' OE1' ' A' ' 26' ' ' GLU . 61.7 ttp180 -129.82 125.13 35.0 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.648 0.261 . . . . 0.0 110.432 179.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -160.01 130.33 5.51 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.459 -0.497 . . . . 0.0 109.745 179.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.49 143.77 3.82 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 120.354 -0.927 . . . . 0.0 111.272 179.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -43.67 167.68 0.03 OUTLIER 'Trans proline' 0 N--CA 1.489 1.23 0 C-N-CA 122.022 1.814 . . . . 0.0 112.446 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -55.68 -52.72 6.9 Favored 'Trans proline' 0 N--CA 1.5 1.857 0 C-N-CA 122.485 2.123 . . . . 0.0 112.501 179.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -86.04 5.53 33.06 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.663 -179.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.0 60.02 16.83 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.833 178.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -77.93 139.52 17.47 Favored 'Trans proline' 0 C--N 1.311 -1.426 0 C-N-CA 122.599 2.199 . . . . 0.0 111.755 178.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.9 mmt180 -128.78 129.42 45.64 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -115.04 102.19 9.7 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.332 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 85.7 mtp180 -101.16 106.93 18.22 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 9.9 t -114.87 129.21 56.66 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.016 -179.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -109.39 157.79 18.57 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.665 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.4 p -125.24 121.32 60.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.196 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 99.1 m -98.52 123.93 42.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.737 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -146.23 132.81 19.81 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.312 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.476 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 51.8 t 47.84 45.14 18.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.837 0.351 . . . . 0.0 110.615 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 61.7 31.55 78.41 Favored Glycine 0 CA--C 1.522 0.505 0 N-CA-C 111.244 -0.742 . . . . 0.0 111.244 179.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.432 ' CG ' ' CE1' ' A' ' 47' ' ' PHE . 11.9 tp-100 -136.81 123.31 20.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.843 0.354 . . . . 0.0 110.167 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.97 109.62 21.68 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.299 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.472 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 60.0 m-85 -91.99 141.04 29.05 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.971 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.468 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 2.6 pm0 -149.71 156.02 41.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.176 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.6 t -96.52 170.75 9.0 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.429 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.5 p -99.21 -0.35 41.64 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.543 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -128.23 129.69 46.8 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.187 0.518 . . . . 0.0 110.706 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.436 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -78.92 148.0 32.85 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.992 -179.689 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.479 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -99.2 147.62 33.52 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.165 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -74.88 -6.89 18.71 Favored 'Trans proline' 0 N--CA 1.497 1.71 0 C-N-CA 122.741 2.294 . . . . 0.0 112.457 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 p -133.45 155.0 50.33 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.221 0.534 . . . . 0.0 111.095 -179.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.77 -64.16 0.91 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.425 -178.549 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -53.71 -33.05 54.27 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.805 0.336 . . . . 0.0 110.381 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.4 t -56.92 -36.93 70.77 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.026 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.8 -45.45 71.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.457 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.62 -39.48 84.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.29 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.657 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -64.32 -52.45 58.39 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.256 0.55 . . . . 0.0 110.735 179.949 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.566 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -65.63 -36.0 82.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.111 -178.553 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.81 -49.28 78.28 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.569 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.62 -32.1 70.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.787 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -54.77 -45.37 74.23 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.675 0.274 . . . . 0.0 110.832 -179.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 23.1 pt -74.08 -34.43 38.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 120.935 0.397 . . . . 0.0 110.677 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.53 -50.63 43.22 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.032 0.444 . . . . 0.0 111.666 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.5 p -63.07 -32.38 56.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.2 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.32 -28.08 65.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.57 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.472 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 18.5 m -68.93 -41.24 78.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.688 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 53.4 mt -67.27 -30.48 70.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.697 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.529 179.962 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.1 ttp . . . . . 0 N--CA 1.489 1.504 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -67.82 142.62 56.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.391 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.609 ' CD2' ' CD2' ' A' ' 61' ' ' HIS . 98.2 m-70 -107.91 120.08 41.26 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.563 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.1 m -109.36 -10.98 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.081 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.674 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -60.33 -45.97 91.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.684 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -61.08 -45.11 96.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.458 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.0 -34.84 90.95 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -73.24 -44.57 59.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.87 0.367 . . . . 0.0 111.227 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 45.6 tp -62.92 -41.19 99.38 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.417 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -64.37 -41.24 96.82 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 119.868 -0.733 . . . . 0.0 110.515 -179.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.73 -37.97 82.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.991 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.613 ' CE1' ' CD2' ' A' ' 16' ' ' HIS . 71.4 t80 -61.52 -50.69 71.69 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.825 -179.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.418 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -55.73 -47.69 76.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.931 0.396 . . . . 0.0 110.329 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.8 tt -63.16 -43.01 99.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.979 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -64.14 -40.97 97.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.627 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.613 ' CD2' ' CE1' ' A' ' 12' ' ' TYR . 78.7 m-70 -89.49 -4.24 58.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.765 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.418 ' N ' ' O ' ' A' ' 13' ' ' ALA . 64.7 t30 61.3 65.32 0.98 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.571 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 78.9 mt -128.51 148.83 50.77 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.601 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.513 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 1.5 mp0 -47.29 147.8 1.47 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.828 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.89 145.28 53.87 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.866 -179.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.68 153.02 64.96 Favored 'Trans proline' 0 N--CA 1.495 1.561 0 C-N-CA 122.4 2.067 . . . . 0.0 111.772 179.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 64.7 t -127.67 130.69 70.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.33 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -107.45 148.69 28.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.695 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.491 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -124.65 111.39 15.56 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.502 ' OD1' ' SG ' ' A' ' 38' ' ' CYS . 45.3 m-80 -109.88 143.55 39.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.735 0.302 . . . . 0.0 110.612 -178.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -148.0 151.25 35.44 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -113.12 134.62 54.46 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.509 ' OE2' ' NE ' ' A' ' 37' ' ' ARG . 4.9 pt-20 -164.63 109.81 0.96 Allowed 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.662 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 164.94 -171.22 40.28 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.402 -0.904 . . . . 0.0 111.263 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.423 ' O ' ' N ' ' A' ' 34' ' ' PRO . 76.3 Cg_exo -45.18 129.92 10.61 Favored 'Trans proline' 0 C--N 1.307 -1.632 0 C-N-CA 122.18 1.92 . . . . 0.0 111.487 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -46.1 -54.86 4.18 Favored 'Trans proline' 0 N--CA 1.497 1.706 0 C-N-CA 122.128 1.886 . . . . 0.0 113.099 -179.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 62.4 t-80 -81.76 -11.26 59.09 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.256 -179.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -143.56 63.52 12.42 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.423 ' N ' ' O ' ' A' ' 30' ' ' PRO . 58.0 Cg_endo -74.07 155.68 47.47 Favored 'Trans proline' 0 N--CA 1.495 1.577 0 C-N-CA 122.426 2.084 . . . . 0.0 112.626 -178.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -101.81 144.29 30.66 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -111.39 105.98 14.76 Favored 'General case' 0 CA--C 1.5 -0.97 0 C-N-CA 120.266 -0.573 . . . . 0.0 111.744 -178.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.509 ' NE ' ' OE2' ' A' ' 28' ' ' GLU . 40.9 mtm180 -106.13 113.18 26.56 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.61 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.502 ' SG ' ' OD1' ' A' ' 25' ' ' ASN . 43.7 t -119.16 150.94 39.19 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.245 0.545 . . . . 0.0 110.97 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.422 ' OD1' ' NE2' ' A' ' 48' ' ' GLN . 94.7 m-20 -122.34 159.83 26.64 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.19 -0.913 . . . . 0.0 110.344 179.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.5 p -124.05 127.38 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.088 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 99.6 m -105.5 122.84 46.83 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.063 179.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.493 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.0 t80 -145.29 136.13 24.56 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 7.0 m 42.26 31.77 0.28 Allowed 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.057 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.83 25.92 61.55 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 120.994 -0.622 . . . . 0.0 111.653 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.493 ' N ' ' O ' ' A' ' 42' ' ' PHE . 85.3 mt-30 -120.44 124.57 45.78 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.724 0.297 . . . . 0.0 110.627 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.5 p -110.41 99.53 8.53 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.307 0.575 . . . . 0.0 111.012 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -100.3 140.6 34.32 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.211 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.422 ' NE2' ' OD1' ' A' ' 39' ' ' ASN . 57.2 tt0 -145.89 148.95 33.38 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.142 -179.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 44.0 t -87.73 161.72 17.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.378 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 79.0 p -91.6 -2.58 57.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.389 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -112.24 133.97 54.05 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.158 0.504 . . . . 0.0 110.532 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.585 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.68 144.65 25.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.648 -179.438 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.62 149.81 38.84 Favored Pre-proline 0 C--N 1.311 -1.092 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.976 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -80.4 -3.06 12.36 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 123.089 2.526 . . . . 0.0 112.666 179.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.453 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 0.8 OUTLIER -127.77 147.69 50.42 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.327 0.584 . . . . 0.0 111.347 -179.193 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tt -65.51 -61.51 2.06 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.865 -178.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -56.41 -35.83 68.25 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 120.795 0.331 . . . . 0.0 111.197 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.453 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 51.2 m -55.39 -33.35 63.39 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.754 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.31 -41.45 69.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.402 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.432 ' OE2' ' ND2' ' A' ' 25' ' ' ASN . 98.4 mt-10 -65.15 -41.73 94.47 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.92 -179.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.609 ' CD2' ' CD2' ' A' ' 3' ' ' HIS . 83.6 m-70 -66.37 -45.62 79.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.052 -179.554 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.01 -36.45 84.44 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.673 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.0 -40.82 86.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.184 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.32 -33.81 74.99 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.824 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -55.22 -46.73 75.95 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.666 0.269 . . . . 0.0 111.173 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.9 pt -71.85 -38.6 65.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.429 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.44 -49.28 61.03 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.0 p -62.07 -31.04 50.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.886 0.374 . . . . 0.0 110.053 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.88 -27.21 62.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.527 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 35.8 t -68.53 -44.47 74.51 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.82 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 56.8 mt -66.88 -30.04 70.09 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.509 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.432 0 CA-C-O 118.003 -0.999 . . . . 0.0 110.58 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.6 m . . . . . 0 N--CA 1.455 -0.19 0 CA-C-O 120.67 0.272 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -58.33 -44.56 88.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.887 0.375 . . . . 0.0 111.112 -178.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -60.07 -42.91 95.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.009 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.53 -31.84 82.22 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 111.146 -0.781 . . . . 0.0 111.146 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -76.22 -46.92 25.95 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.671 0.272 . . . . 0.0 111.415 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.429 HD23 ' OH ' ' A' ' 23' ' ' TYR . 51.0 tp -62.35 -41.32 98.49 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.435 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -64.74 -43.09 94.46 Favored 'General case' 0 N--CA 1.44 -0.95 0 C-N-CA 119.821 -0.752 . . . . 0.0 110.323 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.51 -39.06 85.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.735 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE2' ' CE1' ' A' ' 16' ' ' HIS . 55.9 t80 -62.45 -52.45 63.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.729 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.69 -49.47 76.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.82 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.7 tp -63.47 -45.24 91.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.831 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -64.71 -39.86 94.37 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.542 -178.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE2' ' A' ' 12' ' ' TYR . 72.9 m80 -86.21 -7.3 58.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.67 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 63.1 t30 62.91 66.0 0.77 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.417 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.9 mt -127.55 148.18 50.34 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.641 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -44.71 137.22 4.02 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 121.07 0.462 . . . . 0.0 109.994 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.6 mt -48.98 144.3 7.64 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.732 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.53 154.7 55.25 Favored 'Trans proline' 0 N--CA 1.495 1.607 0 C-N-CA 122.398 2.065 . . . . 0.0 111.979 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.8 t -130.04 130.63 66.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-O 121.246 0.546 . . . . 0.0 110.792 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.429 ' OH ' HD23 ' A' ' 9' ' ' LEU . 33.8 m-85 -106.9 152.89 23.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.874 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -116.6 143.74 45.24 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.547 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -121.2 124.81 45.6 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 120.691 0.281 . . . . 0.0 111.197 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -134.73 132.79 39.23 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 . . . . . 0 CA--C 1.516 -0.358 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 -179.663 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 85.9 mtt85 . . . . . 0 CA--C 1.516 -0.362 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -114.48 103.34 10.94 Favored 'General case' 0 CA--C 1.501 -0.941 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.112 179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -102.76 107.17 17.95 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.522 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.414 ' O ' ' OE1' ' A' ' 48' ' ' GLN . 69.8 m -113.26 129.82 56.42 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.427 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.421 ' OD1' ' OE1' ' A' ' 48' ' ' GLN . 60.0 m-80 -105.56 150.85 25.01 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.77 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.423 ' O ' HG13 ' A' ' 40' ' ' VAL . 3.0 p -120.36 119.68 60.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 98.5 m -97.32 122.3 40.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.307 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -144.64 135.95 25.31 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.324 -0.398 . . . . 0.0 109.965 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.492 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 43.4 t 47.35 36.3 4.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.925 0.393 . . . . 0.0 110.907 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 69.56 32.11 71.09 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.332 -0.707 . . . . 0.0 111.332 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -135.17 128.27 31.73 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.731 0.301 . . . . 0.0 110.39 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 55.2 p -107.53 106.83 17.39 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.979 0.419 . . . . 0.0 111.129 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -92.72 141.71 28.16 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.039 179.547 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.421 ' OE1' ' OD1' ' A' ' 39' ' ' ASN . 69.9 tp60 -152.89 145.55 24.27 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.416 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 92.6 p -86.94 161.2 18.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.412 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.0 p -88.65 -4.05 58.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.895 0.378 . . . . 0.0 110.101 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -112.96 146.62 38.69 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.516 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.68 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -99.96 135.85 40.77 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 121.893 0.854 . . . . 0.0 109.538 -179.97 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.433 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -89.59 150.72 44.83 Favored Pre-proline 0 C--N 1.307 -1.259 0 CA-C-N 114.119 -1.401 . . . . 0.0 110.723 -179.544 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -79.76 -4.57 13.52 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 C-N-CA 122.496 2.13 . . . . 0.0 112.465 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.42 153.44 51.79 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.936 0.398 . . . . 0.0 111.02 -179.145 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.23 -62.82 1.32 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.657 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -55.66 -32.91 63.62 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 120.802 0.334 . . . . 0.0 110.734 -177.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.2 t -56.84 -37.79 71.76 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.829 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.14 -41.71 81.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.057 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -63.5 -44.05 95.48 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.753 0.311 . . . . 0.0 110.841 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 32.7 m-70 -62.06 -48.03 82.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.394 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.52 -36.01 81.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.533 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.65 -48.19 81.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.369 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.68 -33.32 75.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.953 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -54.97 -47.33 74.69 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.614 0.245 . . . . 0.0 111.061 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.4 pt -74.08 -32.21 32.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.5 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.425 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -68.37 -50.29 54.18 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.769 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 p -65.1 -29.98 48.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.743 0.306 . . . . 0.0 110.502 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.24 -33.59 73.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.916 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.425 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 86.1 p . . . . . 0 C--N 1.331 -0.21 0 CA-C-O 120.956 0.408 . . . . 0.0 110.566 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.2 m . . . . . 0 N--CA 1.453 -0.293 0 CA-C-O 120.737 0.303 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -57.91 -44.82 87.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.719 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -58.1 -42.54 85.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.365 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -66.92 -29.74 75.08 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -77.22 -49.3 15.42 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.009 0.433 . . . . 0.0 111.264 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 56.2 tp -62.84 -41.82 99.5 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.445 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -64.7 -40.41 95.32 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 119.538 -0.865 . . . . 0.0 110.611 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.32 -38.32 81.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.557 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -62.13 -49.78 74.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.803 -179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.412 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -57.33 -47.88 80.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.881 0.372 . . . . 0.0 110.39 -179.518 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.2 tp -61.89 -46.2 90.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.615 -179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -65.7 -39.59 91.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.781 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.499 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 60.0 t-80 -88.37 -0.87 57.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.601 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.412 ' N ' ' O ' ' A' ' 13' ' ' ALA . 80.7 m-20 56.17 65.54 1.41 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.671 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 81.7 mt -127.07 148.87 50.13 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.413 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -46.34 134.58 8.79 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.752 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.3 mt -46.91 144.8 3.56 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.692 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.89 153.5 63.72 Favored 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 122.215 1.944 . . . . 0.0 111.878 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 73.6 t -129.83 130.43 66.52 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.339 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -106.37 152.77 23.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.41 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.474 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -117.53 140.54 49.48 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.279 178.289 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -119.47 125.66 49.44 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.962 0.41 . . . . 0.0 111.319 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -135.0 133.84 39.86 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.061 178.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 69.8 ttp85 . . . . . 0 CA--C 1.518 -0.279 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.172 -179.653 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 91.1 mtm180 . . . . . 0 CA--C 1.516 -0.359 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -113.67 103.55 11.34 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.217 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -99.62 106.33 18.29 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.474 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 45.1 t -112.23 124.42 52.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.489 -179.515 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -107.77 151.58 25.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.079 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.462 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.0 p -120.59 120.03 61.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.303 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.165 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 87.2 m -96.07 121.42 37.8 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.283 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.556 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 5.0 t80 -142.18 138.99 31.93 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.189 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.556 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 4.0 m 45.25 31.98 0.9 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.743 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 74.88 32.17 57.22 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 42' ' ' PHE . 86.6 mt-30 -136.59 126.76 26.29 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 45.7 p -104.86 106.89 17.58 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.957 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -91.3 140.95 29.3 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.201 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -150.1 150.77 32.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.372 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 29.3 t -91.31 164.38 13.88 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.515 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.8 m -89.41 -7.39 55.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.584 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -117.66 136.9 53.02 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.323 0.582 . . . . 0.0 110.188 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.526 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -90.22 144.13 26.13 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.55 -179.07 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -95.61 148.97 35.44 Favored Pre-proline 0 C--N 1.317 -0.806 0 CA-C-N 114.757 -1.11 . . . . 0.0 111.174 -179.66 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -80.37 -3.81 12.74 Favored 'Trans proline' 0 N--CA 1.494 1.547 0 C-N-CA 122.848 2.365 . . . . 0.0 111.941 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.14 154.02 47.92 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.228 0.537 . . . . 0.0 110.822 -179.346 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.1 tt -70.25 -64.99 0.78 Allowed 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.475 -178.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -55.19 -35.53 64.92 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 120.98 0.419 . . . . 0.0 110.554 -178.135 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.3 m -55.32 -34.8 64.51 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.016 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.436 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -70.81 -40.3 72.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.782 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -63.03 -41.25 99.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.331 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -63.76 -49.22 73.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.794 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.57 -35.43 79.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.926 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.94 -48.64 79.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.783 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.47 -33.53 74.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.053 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -54.9 -45.24 74.69 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.685 0.279 . . . . 0.0 111.456 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 22.1 pt -73.27 -33.94 42.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.578 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.59 -50.52 43.81 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.705 -178.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.9 p -63.49 -32.26 56.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.188 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.25 -30.24 68.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.715 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.7 m . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.762 -179.972 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.7 m . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 120.742 0.306 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -56.45 -46.17 80.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.804 -179.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -60.83 -41.98 96.85 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.632 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.85 -33.44 85.79 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -77.74 -49.87 13.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.237 0.541 . . . . 0.0 111.235 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 29.5 tp -62.09 -42.32 99.09 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.169 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -62.85 -41.89 99.54 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.683 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.83 -36.54 80.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.49 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.621 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 83.1 t80 -61.22 -50.61 72.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.816 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.41 -51.53 69.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.904 0.383 . . . . 0.0 110.663 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 51.2 tp -62.85 -44.12 96.99 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.732 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 69.8 tp60 -64.11 -38.49 91.25 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.569 -178.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 68.1 m80 -91.78 -0.46 57.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.718 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 64.7 t30 58.04 66.33 1.13 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.592 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.9 mt -127.93 146.62 50.58 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.017 0.437 . . . . 0.0 110.575 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.512 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 57.0 mp0 -42.62 133.4 3.44 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.103 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.546 ' N ' HD12 ' A' ' 20' ' ' LEU . 10.5 mp -47.2 145.55 3.55 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.691 -178.82 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.42 153.71 55.6 Favored 'Trans proline' 0 N--CA 1.492 1.441 0 C-N-CA 122.497 2.131 . . . . 0.0 111.881 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 67.3 t -128.85 131.87 67.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.324 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -107.34 152.88 23.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.672 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -115.91 144.47 44.0 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.456 178.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -124.95 123.6 40.23 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.288 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 83.9 mt-10 -133.87 130.72 38.24 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 . . . . . 0 CA--C 1.517 -0.322 0 CA-C-O 120.788 0.328 . . . . 0.0 110.286 -179.538 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 87.5 mtm180 . . . . . 0 CA--C 1.515 -0.392 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -114.22 103.78 11.44 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.036 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -102.34 105.36 15.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.12 0.486 . . . . 0.0 109.731 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 69.0 m -114.08 132.93 55.86 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.452 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -111.41 155.52 23.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.293 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.421 ' O ' HG13 ' A' ' 40' ' ' VAL . 2.9 p -121.11 119.9 60.62 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.301 0 CA-C-O 120.923 0.392 . . . . 0.0 109.95 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 74.8 m -97.33 124.88 41.61 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.681 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -146.08 136.83 24.29 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.125 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.441 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 49.6 t 46.76 32.82 1.88 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.808 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 74.11 32.85 57.98 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 111.236 -0.745 . . . . 0.0 111.236 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -136.56 123.62 21.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.804 0.335 . . . . 0.0 110.217 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.2 p -106.13 108.73 20.4 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.115 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -94.5 141.6 28.4 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.007 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -147.86 145.91 28.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.892 0.377 . . . . 0.0 110.422 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.1 p -84.7 163.18 19.36 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.307 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.1 p -90.86 -2.51 57.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.536 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -118.29 154.43 32.3 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.222 0.534 . . . . 0.0 110.105 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.687 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -103.68 134.26 47.31 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.909 -179.405 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.43 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -88.02 147.54 40.99 Favored Pre-proline 0 C--N 1.311 -1.107 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.935 -179.838 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.15 -5.33 16.16 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.759 2.306 . . . . 0.0 112.381 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.429 ' O ' ' OG ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -136.06 155.79 49.69 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.001 0.429 . . . . 0.0 111.107 -179.216 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.97 -64.13 0.92 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.93 -178.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -54.22 -36.17 63.22 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.937 -177.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 55' ' ' THR . 77.8 p -56.05 -33.02 64.58 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.14 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.42 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -71.67 -42.24 67.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.896 0.379 . . . . 0.0 111.128 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -64.21 -42.14 96.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.532 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 43.7 m-70 -66.17 -46.8 76.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.718 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.66 -37.98 83.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.762 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.25 -45.47 94.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.687 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.6 -37.07 77.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.364 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.36 -50.03 75.1 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.356 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 96.6 mt -57.82 -47.78 85.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.216 -178.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.6 -43.88 88.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.008 0.432 . . . . 0.0 110.501 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.2 t -59.48 -41.21 83.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.142 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.08 -29.88 70.78 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.652 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.793 -179.929 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.5 m . . . . . 0 N--CA 1.454 -0.243 0 N-CA-C 110.452 -0.203 . . . . 0.0 110.452 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -60.31 -44.94 94.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.796 0.332 . . . . 0.0 110.815 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -59.1 -41.66 88.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.533 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.6 -28.01 73.44 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -77.64 -49.61 14.18 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.021 0.438 . . . . 0.0 111.018 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.1 tp -61.63 -42.16 98.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.723 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -62.23 -40.14 95.17 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.833 -179.14 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.28 -38.07 78.18 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.408 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.618 ' CE1' ' CD2' ' A' ' 16' ' ' HIS . 83.9 t80 -62.05 -51.7 66.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.609 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.492 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.81 -49.21 76.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.514 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 51.5 tp -62.41 -44.79 95.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.636 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -65.35 -39.48 92.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.588 -179.026 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.618 ' CD2' ' CE1' ' A' ' 12' ' ' TYR . 66.5 m-70 -90.28 -5.71 55.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.6 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.492 ' N ' ' O ' ' A' ' 13' ' ' ALA . 64.5 t30 60.72 67.12 0.85 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.559 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 75.7 mt -126.66 148.12 49.86 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.937 0.398 . . . . 0.0 110.584 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.568 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 55.4 mp0 -42.51 131.92 3.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.269 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 pp -46.08 144.57 2.93 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.635 -179.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -72.53 155.42 54.93 Favored 'Trans proline' 0 C--N 1.308 -1.585 0 C-N-CA 122.769 2.313 . . . . 0.0 112.167 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 59.1 t -130.69 132.02 64.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.458 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -108.88 153.54 23.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.765 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -116.16 144.06 44.67 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.817 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -123.61 122.91 39.37 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.937 -179.13 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -132.39 126.84 34.1 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.735 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 . . . . . 0 C--O 1.235 0.295 0 CA-C-O 120.844 0.354 . . . . 0.0 110.374 -179.507 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 85.0 mtt85 . . . . . 0 CA--C 1.516 -0.36 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -113.65 104.03 11.82 Favored 'General case' 0 C--O 1.217 -0.635 0 C-N-CA 120.479 -0.488 . . . . 0.0 111.335 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -106.21 104.38 14.07 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 81.2 m -113.08 133.53 54.96 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.309 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -111.34 153.98 25.21 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.313 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.442 ' O ' HG13 ' A' ' 40' ' ' VAL . 3.4 p -121.3 119.7 59.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 121.032 0.444 . . . . 0.0 110.159 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 98.0 m -97.07 123.3 40.78 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.788 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -145.26 136.95 25.39 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.325 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.492 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 43.9 t 46.54 36.05 3.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.528 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 70.56 32.77 67.48 Favored Glycine 0 CA--C 1.52 0.371 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.0 mm100 -136.25 125.54 24.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.722 0.296 . . . . 0.0 110.342 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.0 p -106.83 107.54 18.61 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.965 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.406 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 54.5 m-85 -92.85 140.94 28.98 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.008 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -147.65 151.08 35.58 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.392 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.6 m -88.74 160.68 17.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.463 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 86.8 p -86.37 -7.74 58.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.548 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -127.64 132.16 49.78 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.412 0.625 . . . . 0.0 110.771 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -80.28 148.75 30.61 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.136 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.556 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -98.1 149.69 35.99 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.875 -179.756 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -75.68 -4.39 15.17 Favored 'Trans proline' 0 C--N 1.311 -1.41 0 C-N-CA 122.764 2.309 . . . . 0.0 112.357 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.445 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -130.54 153.23 49.07 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.235 0.541 . . . . 0.0 110.722 -179.343 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.1 tt -69.7 -66.46 0.59 Allowed 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.293 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -53.41 -36.59 61.65 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.515 -178.032 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.445 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 79.1 p -54.73 -32.38 59.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.284 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.27 -40.73 70.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.856 0.36 . . . . 0.0 110.813 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -64.91 -38.67 91.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.477 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 22.9 m170 -64.58 -51.77 61.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.81 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.38 -34.33 77.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.645 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.19 -46.76 85.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.639 -179.211 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.03 -32.71 70.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.651 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -54.18 -45.34 72.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.825 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.8 pt -74.22 -32.87 33.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.068 0.461 . . . . 0.0 110.804 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.18 -50.27 41.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.239 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.6 p -64.36 -31.18 52.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.626 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.42 -28.78 65.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.524 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.406 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 15.6 m . . . . . 0 C--N 1.329 -0.295 0 CA-C-O 121.063 0.458 . . . . 0.0 110.661 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 24.1 m . . . . . 0 N--CA 1.457 -0.095 0 CA-C-O 120.701 0.286 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -59.19 -44.37 92.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.834 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -58.51 -43.09 88.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.258 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.41 -28.27 73.33 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 111.234 -0.746 . . . . 0.0 111.234 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -77.4 -49.58 14.58 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.88 0.372 . . . . 0.0 110.978 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 59.0 tp -63.21 -41.2 99.1 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.323 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -62.49 -41.28 98.69 Favored 'General case' 0 C--N 1.311 -1.101 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.623 -179.125 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.09 -37.85 81.68 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.934 179.516 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 80.5 t80 -61.67 -51.22 69.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.775 -179.333 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.32 -48.5 80.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.434 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.3 tp -62.73 -44.24 96.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.469 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.9 tp60 -65.24 -40.19 93.71 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.601 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 69.1 m80 -89.55 -1.69 58.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.692 -179.597 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 60.9 t-20 58.59 65.95 1.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.546 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.8 mt -127.4 151.15 49.17 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.583 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -45.58 129.52 8.75 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.722 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.487 HD23 ' H ' ' A' ' 20' ' ' LEU . 0.2 OUTLIER -46.35 146.27 2.4 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.598 -178.876 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.26 152.88 66.97 Favored 'Trans proline' 0 N--CA 1.494 1.501 0 C-N-CA 122.396 2.064 . . . . 0.0 112.041 179.243 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.1 t -129.83 129.39 66.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.535 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -104.73 152.61 22.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.331 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.458 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -117.93 145.24 44.82 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.526 178.32 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -121.5 125.62 47.26 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.665 0.269 . . . . 0.0 111.245 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -134.69 123.64 24.02 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 . . . . . 0 CA--C 1.512 -0.501 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 -179.834 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.401 ' NH2' ' CD1' ' A' ' 52' ' ' PHE . 82.8 mtp180 . . . . . 0 CA--C 1.515 -0.379 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -114.96 103.83 11.31 Favored 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 120.161 -0.616 . . . . 0.0 111.296 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.7 mtm180 -101.77 106.36 17.35 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.077 0.465 . . . . 0.0 110.226 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.458 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 42.1 t -109.79 124.5 51.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.375 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -106.63 150.55 26.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.711 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.433 ' O ' HG13 ' A' ' 40' ' ' VAL . 3.4 p -119.28 119.46 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.11 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 94.8 m -94.66 120.19 34.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.212 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.486 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 4.5 t80 -141.36 138.01 32.74 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.203 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.486 ' SG ' ' O ' ' A' ' 42' ' ' PHE . 13.8 p 41.9 44.13 2.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.945 0.402 . . . . 0.0 110.718 179.625 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 64.64 32.63 84.84 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.443 ' N ' ' O ' ' A' ' 42' ' ' PHE . 47.6 tp60 -137.73 122.51 18.76 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.912 0.387 . . . . 0.0 110.384 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 32.7 p -103.69 109.08 20.64 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.129 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.499 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 15.9 m-85 -89.9 140.74 29.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.859 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -144.95 154.01 42.13 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.341 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.1 m -98.62 159.85 14.67 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.415 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 93.7 p -89.88 -6.88 55.35 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.56 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -116.26 148.88 40.03 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.146 0.498 . . . . 0.0 110.189 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.689 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -101.59 131.26 47.88 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-N 115.228 -0.897 . . . . 0.0 109.822 -179.331 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.462 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -85.98 148.84 49.06 Favored Pre-proline 0 C--N 1.307 -1.247 0 CA-C-N 114.142 -1.39 . . . . 0.0 110.688 -179.566 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -77.42 -5.17 15.39 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 122.395 2.064 . . . . 0.0 112.563 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.4 HG22 ' N ' ' A' ' 56' ' ' LEU . 48.7 m -135.43 153.09 51.9 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.255 0.55 . . . . 0.0 111.179 -179.38 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.4 ' N ' HG22 ' A' ' 55' ' ' THR . 0.5 OUTLIER -64.7 -62.56 1.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.554 -178.782 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.47 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 69.0 mttm -55.07 -33.63 62.91 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 120.992 0.425 . . . . 0.0 110.601 -177.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.4 t -56.46 -36.93 69.62 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.003 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.87 -41.62 74.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.7 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -61.13 -40.81 95.2 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.42 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.603 ' ND1' ' N ' ' A' ' 61' ' ' HIS . 0.4 OUTLIER -67.5 -44.87 77.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.656 -179.525 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.92 -40.85 87.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.074 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.77 -50.68 72.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.682 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.459 ' O ' HG12 ' A' ' 68' ' ' VAL . . . -61.33 -37.73 84.34 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.351 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -55.81 -45.89 78.17 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.881 0.372 . . . . 0.0 110.324 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.62 -43.82 93.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.862 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.24 -49.56 64.01 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -178.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 64' ' ' ALA . 8.4 p -65.05 -31.77 55.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.175 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.95 -27.56 65.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.633 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 59.7 p . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.599 179.93 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 32.7 m . . . . . 0 N--CA 1.452 -0.354 0 CA-C-O 120.574 0.226 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -55.77 -43.74 77.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.828 0.346 . . . . 0.0 110.923 -178.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -59.88 -42.59 94.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.437 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -74.55 -26.32 67.95 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.66 -0.576 . . . . 0.0 111.66 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -77.17 -49.02 16.1 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.655 0.264 . . . . 0.0 111.506 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.6 tp -63.58 -41.37 98.38 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.179 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -65.12 -42.13 94.22 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.257 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.14 -37.57 84.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.667 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 92.4 t80 -61.5 -48.93 78.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.657 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.441 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.82 -45.83 82.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.798 0.332 . . . . 0.0 110.521 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.3 tp -62.86 -46.17 89.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.729 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -66.04 -42.68 89.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.966 0.413 . . . . 0.0 110.627 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.481 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 66.9 t-80 -84.8 -5.43 59.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.831 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.441 ' N ' ' O ' ' A' ' 13' ' ' ALA . 61.7 t-20 58.66 65.46 1.24 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.716 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.407 HD21 ' ND1' ' A' ' 16' ' ' HIS . 80.5 mt -123.38 148.37 46.14 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.683 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -41.72 152.64 0.07 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.302 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.445 ' CD2' ' N ' ' A' ' 20' ' ' LEU . 3.6 mm? -61.61 139.43 95.18 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.468 -178.577 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -72.07 152.89 57.32 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 122.362 2.042 . . . . 0.0 112.013 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 72.2 t -131.45 130.96 63.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.935 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -107.28 152.22 24.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.422 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.442 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -115.94 141.53 47.99 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 115.602 -0.727 . . . . 0.0 109.133 178.12 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -119.8 125.14 47.84 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.751 0.31 . . . . 0.0 111.353 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -134.01 128.69 34.87 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 . . . . . 0 CA--C 1.512 -0.482 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -179.533 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 . . . . . 0 N--CA 1.464 0.251 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -114.54 103.07 10.65 Favored 'General case' 0 CA--C 1.498 -1.029 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.963 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.9 mmm-85 -101.31 107.41 18.76 Favored 'General case' 0 C--N 1.316 -0.856 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.386 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 43.7 t -111.85 126.21 54.85 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.787 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -106.36 152.98 22.87 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 p -121.14 120.4 62.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.279 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 52.1 m -98.22 120.44 38.64 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.913 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.497 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 6.3 t80 -144.06 137.35 27.53 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.264 -0.425 . . . . 0.0 109.988 -179.689 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.497 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 7.6 m 47.46 40.04 10.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.832 0.349 . . . . 0.0 110.754 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 66.02 31.72 80.31 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 111.598 -0.601 . . . . 0.0 111.598 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -135.83 126.01 26.31 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.746 0.307 . . . . 0.0 110.355 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 27.6 m -107.51 108.83 20.32 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.877 0.37 . . . . 0.0 110.852 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -93.31 141.92 27.9 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.744 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -142.94 144.23 32.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.593 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.5 p -84.11 162.19 20.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.634 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.7 p -93.3 -7.53 44.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.225 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -116.96 152.58 34.27 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.364 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.699 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -103.73 132.48 49.94 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.85 0.833 . . . . 0.0 109.735 -179.671 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.406 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -87.48 149.42 46.58 Favored Pre-proline 0 C--N 1.303 -1.423 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.454 -179.855 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.12 -5.1 14.91 Favored 'Trans proline' 0 N--CA 1.494 1.515 0 C-N-CA 122.588 2.192 . . . . 0.0 112.704 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 51.6 m -135.09 150.95 50.32 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.875 0.369 . . . . 0.0 111.201 -178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.31 -61.73 2.16 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.734 -178.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.523 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 68.8 mttm -54.95 -34.44 63.27 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 120.792 0.33 . . . . 0.0 110.91 -178.166 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.2 t -55.57 -38.42 69.33 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.066 0.46 . . . . 0.0 109.849 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.59 -41.68 79.28 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.345 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -64.12 -43.67 94.58 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.764 0.316 . . . . 0.0 110.821 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.523 ' CD2' ' O ' ' A' ' 57' ' ' LYS . 84.8 m-70 -67.38 -45.61 75.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.674 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.0 -40.37 87.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.2 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.01 -45.37 93.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.839 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.41 ' O ' HG23 ' A' ' 68' ' ' VAL . . . -58.95 -38.19 78.48 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.527 -179.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -57.83 -48.45 79.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.789 179.132 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.6 mt -57.87 -48.88 82.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.166 -178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.03 -43.47 92.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.639 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 64' ' ' ALA . 20.8 t -59.14 -42.58 87.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 109.994 -179.595 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.99 -29.86 71.15 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.929 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.8 t . . . . . 0 CA--C 1.53 0.192 0 CA-C-O 120.876 0.369 . . . . 0.0 111.285 179.767 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.9 m . . . . . 0 N--CA 1.455 -0.215 0 CA-C-O 120.61 0.243 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -61.43 -42.79 99.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.8 0.334 . . . . 0.0 111.063 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -59.33 -39.6 83.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.412 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.28 -24.34 59.36 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -77.28 -50.1 13.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.149 0.5 . . . . 0.0 110.859 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.5 tp -63.27 -41.79 99.06 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.328 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.0 tp-100 -60.79 -41.3 95.3 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 120.086 -0.645 . . . . 0.0 110.803 -178.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.67 -37.3 86.12 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.426 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 81.0 t80 -61.35 -49.87 75.21 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.898 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.488 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.96 -49.39 75.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.953 0.406 . . . . 0.0 110.293 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.2 tp -62.78 -44.25 96.66 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.581 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -64.17 -37.32 87.05 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.698 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 59.3 m80 -94.83 -2.36 50.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.7 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 13' ' ' ALA . 55.2 t-20 59.29 66.57 1.01 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.715 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 71.5 mt -124.49 149.96 46.29 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.459 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -46.06 134.58 8.16 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.906 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.49 HD23 ' H ' ' A' ' 20' ' ' LEU . 0.2 OUTLIER -46.91 146.73 2.57 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.745 -178.844 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.36 154.66 45.93 Favored 'Trans proline' 0 N--CA 1.496 1.631 0 C-N-CA 122.758 2.306 . . . . 0.0 112.354 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.0 t -129.9 130.38 66.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.379 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -107.42 152.34 24.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.857 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.438 ' HB3' ' CG ' ' A' ' 39' ' ' ASN . . . -119.68 134.87 55.06 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.642 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -115.59 125.68 53.25 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.983 0.42 . . . . 0.0 111.516 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -129.83 127.75 40.91 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.515 178.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 . . . . . 0 CA--C 1.515 -0.371 0 CA-C-O 120.657 0.265 . . . . 0.0 110.314 -179.546 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 87.5 mtm180 . . . . . 0 CA--C 1.514 -0.408 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -113.78 104.13 11.9 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.461 -0.496 . . . . 0.0 111.144 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.432 ' NH2' ' OE1' ' A' ' 48' ' ' GLN . 81.1 mtp85 -106.34 105.46 15.5 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.1 m -119.15 144.0 46.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.067 0.461 . . . . 0.0 110.203 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.438 ' CG ' ' HB3' ' A' ' 24' ' ' ALA . 13.6 p30 -124.3 160.1 28.78 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.452 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.427 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.1 p -120.28 120.69 63.63 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.253 0 CA-C-O 121.119 0.485 . . . . 0.0 110.202 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.407 ' OG1' HG22 ' A' ' 46' ' ' THR . 66.7 m -95.9 116.96 29.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.152 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -139.34 137.36 35.71 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.97 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.497 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 43.1 t 48.04 32.3 2.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.814 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.86 33.52 57.5 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -137.87 122.86 19.03 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.407 HG22 ' OG1' ' A' ' 41' ' ' THR . 18.7 p -105.02 109.56 21.61 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.05 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -95.12 141.42 28.77 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.084 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.432 ' OE1' ' NH2' ' A' ' 37' ' ' ARG . 7.0 tt0 -148.31 144.51 27.63 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.856 0.36 . . . . 0.0 110.546 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.3 p -84.3 163.13 19.81 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.631 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.0 m -89.76 -7.34 54.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.648 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -112.28 148.94 33.11 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.128 0.49 . . . . 0.0 109.929 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.685 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -101.61 131.95 47.54 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.481 -179.615 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.503 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -86.43 148.29 46.45 Favored Pre-proline 0 C--N 1.307 -1.257 0 CA-C-N 114.076 -1.42 . . . . 0.0 111.131 -179.489 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -77.42 -8.38 17.25 Favored 'Trans proline' 0 N--CA 1.495 1.584 0 C-N-CA 122.674 2.25 . . . . 0.0 111.984 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 41.5 m -129.07 148.4 51.02 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.772 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 56' ' ' LEU . 1.4 tt -63.83 -61.9 1.99 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.159 -178.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -54.49 -34.21 61.21 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 121.028 -0.269 . . . . 0.0 110.741 -178.287 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.5 t -55.89 -34.03 65.17 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.104 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.87 -41.98 67.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.158 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -63.99 -41.68 97.43 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.663 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -66.99 -47.76 70.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.811 0.339 . . . . 0.0 110.83 -179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.51 -38.29 84.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.606 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.8 -48.37 82.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.597 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.06 -36.81 80.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.366 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.0 -47.43 83.05 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 97.1 mt -59.69 -45.92 93.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.106 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.32 -43.29 86.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.087 0.47 . . . . 0.0 110.41 179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.1 t -59.56 -42.3 87.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.216 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.05 -27.45 69.11 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.969 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.4 t . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.557 -179.896 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 N--CA 1.455 -0.223 0 CA-C-O 120.58 0.229 . . . . 0.0 110.936 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.639 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 4.7 m-85 -58.14 -42.97 87.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.862 -178.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.412 ' NZ ' ' OE1' ' A' ' 60' ' ' GLU . 98.8 mttt -59.45 -40.37 86.62 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.213 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -69.99 -28.15 72.13 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.202 -0.759 . . . . 0.0 111.202 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -77.28 -50.68 12.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.103 0.478 . . . . 0.0 111.357 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 56.1 tp -62.38 -41.51 98.7 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.259 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -62.53 -39.62 94.16 Favored 'General case' 0 C--N 1.31 -1.134 0 C-N-CA 119.641 -0.824 . . . . 0.0 110.035 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.42 -39.39 77.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.82 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -61.78 -52.61 63.52 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.031 -179.174 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.87 -47.86 79.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.021 0.439 . . . . 0.0 110.304 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.8 tp -62.56 -44.41 96.39 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.593 -179.525 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -65.03 -40.89 95.49 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.597 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.525 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 64.8 t-80 -87.03 -2.8 58.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.77 -179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 58.5 t30 58.72 65.56 1.22 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.888 0.375 . . . . 0.0 110.185 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.8 mt -128.67 147.43 50.74 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.498 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -41.7 133.41 2.73 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.568 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.5 mt -48.13 144.39 5.99 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.96 -179.161 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -70.6 153.94 64.74 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.317 2.012 . . . . 0.0 111.952 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.5 t -131.43 130.54 62.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.636 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -105.22 153.11 22.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.447 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.475 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -119.57 140.81 49.96 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.371 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -118.05 126.69 52.77 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.787 0.327 . . . . 0.0 111.205 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -136.5 131.16 33.59 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 178.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.9 ttp85 . . . . . 0 CA--C 1.515 -0.381 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.649 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.609 ' NH1' ' CD1' ' A' ' 52' ' ' PHE . 96.5 mtt-85 . . . . . 0 CA--C 1.517 -0.295 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -114.36 103.96 11.59 Favored 'General case' 0 CA--C 1.508 -0.639 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.85 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -99.97 106.61 18.43 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.646 -0.422 . . . . 0.0 109.909 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.475 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 45.9 t -111.02 123.05 49.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.505 -179.479 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -106.47 150.55 25.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.002 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.483 ' O ' HG13 ' A' ' 40' ' ' VAL . 5.5 p -119.76 119.74 61.23 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.201 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 96.5 m -93.96 122.12 36.14 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.375 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -143.0 131.99 22.94 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.473 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 49.9 t 46.14 46.7 13.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.933 0.397 . . . . 0.0 110.81 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.09 33.2 84.97 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.281 -0.727 . . . . 0.0 111.281 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.423 ' CG ' ' CE1' ' A' ' 47' ' ' PHE . 68.1 tp60 -139.28 125.17 19.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.826 0.346 . . . . 0.0 110.203 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.8 p -105.41 109.95 22.11 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.233 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.423 ' CE1' ' CG ' ' A' ' 45' ' ' GLN . 51.4 m-85 -90.77 140.88 29.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.165 -0.47 . . . . 0.0 109.782 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -148.51 149.4 31.58 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.175 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 42.5 t -88.69 162.12 16.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.642 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 96.4 p -87.67 -6.8 58.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.716 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -123.1 143.45 49.97 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.211 0.529 . . . . 0.0 110.781 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.609 ' CD1' ' NH1' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -91.7 142.62 27.41 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.891 -179.272 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.501 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -94.22 147.59 33.63 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 114.659 -1.155 . . . . 0.0 111.185 -179.568 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -76.15 -4.71 15.45 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 C-N-CA 122.69 2.26 . . . . 0.0 112.496 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.33 155.37 50.71 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.225 0.536 . . . . 0.0 111.132 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.03 -64.04 0.94 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.371 -178.562 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -54.64 -34.23 61.82 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 120.659 0.266 . . . . 0.0 110.575 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.6 t -55.79 -36.44 67.39 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.573 -0.451 . . . . 0.0 109.803 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.482 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -70.84 -41.19 71.79 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.5 -179.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.412 ' OE1' ' NZ ' ' A' ' 6' ' ' LYS . 98.7 mt-10 -62.15 -43.06 99.68 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.874 -179.395 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.639 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -62.7 -51.38 67.41 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.208 0.528 . . . . 0.0 110.311 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.57 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -64.84 -35.24 80.47 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.176 -178.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.79 -49.39 77.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.594 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.7 -32.52 71.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.612 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -55.22 -45.75 75.96 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.619 0.247 . . . . 0.0 111.151 -179.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.3 pt -72.12 -37.45 59.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.62 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.85 -50.44 56.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.001 0.429 . . . . 0.0 111.961 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.96 -36.81 78.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.67 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.61 -26.96 68.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.755 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 37.5 m . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.936 179.743 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.1 m . . . . . 0 CA--C 1.522 -0.121 0 CA-C-O 120.618 0.247 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -60.13 -42.17 94.22 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.826 0.346 . . . . 0.0 110.867 -178.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -60.87 -41.25 95.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.211 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.37 -31.62 81.47 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.736 -0.946 . . . . 0.0 110.736 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -75.94 -48.53 20.84 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.709 0.29 . . . . 0.0 111.459 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.431 HD23 ' OH ' ' A' ' 23' ' ' TYR . 48.2 tp -62.99 -39.42 94.66 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.305 -179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -63.06 -41.66 99.5 Favored 'General case' 0 N--CA 1.437 -1.105 0 C-N-CA 119.655 -0.818 . . . . 0.0 110.285 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.64 -40.25 84.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.895 179.459 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.42 ' O ' ' N ' ' A' ' 16' ' ' HIS . 53.8 t80 -61.98 -51.28 68.69 Favored 'General case' 0 N--CA 1.462 0.148 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.805 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.98 -40.4 73.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.433 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 39.1 tp -63.17 -46.21 88.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.529 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -79.61 -20.52 46.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.975 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.42 ' N ' ' O ' ' A' ' 12' ' ' TYR . 38.8 t-80 -87.15 -13.55 43.74 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.693 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 49.62 64.88 1.58 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.249 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.551 HD21 ' CZ ' ' A' ' 42' ' ' PHE . 0.9 OUTLIER -139.79 169.16 18.22 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.982 0.42 . . . . 0.0 110.452 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -46.36 126.08 7.54 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.739 178.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.539 HD23 ' H ' ' A' ' 20' ' ' LEU . 0.2 OUTLIER -45.81 151.42 0.85 Allowed Pre-proline 0 CA--C 1.539 0.542 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.669 -178.95 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.18 151.03 72.39 Favored 'Trans proline' 0 N--CA 1.499 1.802 0 C-N-CA 122.42 2.08 . . . . 0.0 112.215 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.4 t -133.51 131.08 57.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.227 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.431 ' OH ' HD23 ' A' ' 9' ' ' LEU . 32.2 m-85 -106.14 152.13 23.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.885 179.319 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.43 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -114.56 146.01 41.27 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.1 178.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -124.42 124.56 42.6 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.788 0.328 . . . . 0.0 111.636 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -132.75 129.07 38.16 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 71.2 ttt-85 . . . . . 0 CA--C 1.516 -0.359 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.355 -179.528 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 . . . . . 0 N--CA 1.464 0.267 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -114.56 102.39 10.01 Favored 'General case' 0 CA--C 1.505 -0.787 0 C-N-CA 119.647 -0.821 . . . . 0.0 111.53 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.5 mtp85 -101.08 107.82 19.35 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.789 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.43 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 48.4 t -109.53 122.35 47.24 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.634 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.508 ' OD1' ' N ' ' A' ' 40' ' ' VAL . 40.8 t-20 -103.61 150.74 23.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.701 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.508 ' N ' ' OD1' ' A' ' 39' ' ' ASN . 4.0 p -122.42 119.6 58.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.866 0.365 . . . . 0.0 110.417 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 98.3 m -96.47 121.33 38.16 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.072 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.551 ' CZ ' HD21 ' A' ' 18' ' ' LEU . 6.1 t80 -144.19 136.0 26.09 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.422 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 42.7 t 45.82 44.65 11.07 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.411 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.54 30.76 77.48 Favored Glycine 0 CA--C 1.526 0.776 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.921 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -135.48 131.06 35.64 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 122.691 -0.299 . . . . 0.0 110.314 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 54.4 p -108.8 107.4 17.81 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.047 0.451 . . . . 0.0 111.101 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -92.7 141.56 28.34 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.111 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -152.23 147.7 26.7 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.749 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.4 p -85.79 166.14 16.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.818 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 85.3 p -92.64 -6.96 48.28 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.626 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -122.7 129.51 51.89 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.006 0.432 . . . . 0.0 110.898 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -79.2 148.64 32.19 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.686 0.755 . . . . 0.0 110.17 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.485 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -96.22 150.33 37.05 Favored Pre-proline 0 C--N 1.313 -0.982 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.857 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -77.6 -4.41 14.57 Favored 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 122.421 2.081 . . . . 0.0 112.712 178.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.8 152.42 51.74 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 120.961 0.41 . . . . 0.0 110.851 -179.516 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.43 -62.44 1.53 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.762 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -56.11 -35.97 67.68 Favored 'General case' 0 CA--C 1.52 -0.198 0 O-C-N 122.137 -0.352 . . . . 0.0 110.816 -177.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 38.5 m -54.68 -36.12 64.3 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.451 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -69.1 -43.21 74.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.454 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.54 -41.86 97.97 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.463 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 32.0 m-70 -62.73 -48.81 77.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.766 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.05 -35.51 80.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.827 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.47 -48.88 79.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.478 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.86 -33.49 75.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -54.79 -46.91 74.51 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.656 0.265 . . . . 0.0 111.084 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.1 pt -73.97 -33.11 35.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.872 0.368 . . . . 0.0 110.663 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.435 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -67.33 -50.26 60.76 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.831 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.3 p -65.4 -30.11 49.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.527 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.41 -33.86 73.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.118 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.435 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 78.0 p . . . . . 0 C--N 1.331 -0.216 0 CA-C-O 121.019 0.438 . . . . 0.0 110.576 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.531 0.245 0 CA-C-O 120.966 0.412 . . . . 0.0 110.635 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.628 ' N ' ' CD1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -61.17 -23.83 65.85 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.859 -179.551 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -62.39 -42.39 99.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.154 0.502 . . . . 0.0 110.322 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.72 -23.55 76.44 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.086 -0.806 . . . . 0.0 111.086 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -78.04 -50.35 12.25 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.83 0.348 . . . . 0.0 111.179 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.5 tp -62.74 -42.59 99.74 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.14 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.9 tp-100 -64.45 -42.58 95.88 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.138 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.91 -37.27 78.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.824 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -61.52 -49.83 75.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.679 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.473 ' HB2' ' HZ ' ' A' ' 42' ' ' PHE . . . -58.6 -47.3 84.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.934 0.397 . . . . 0.0 110.246 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.4 tp -62.15 -46.37 89.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.517 -179.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -65.76 -38.7 89.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.976 0.417 . . . . 0.0 110.487 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.502 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 61.6 t-80 -87.51 -0.58 57.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.607 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 56.5 65.1 1.5 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.642 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 81.6 mt -127.71 151.7 48.65 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.678 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -46.86 128.0 10.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.131 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.573 ' N ' HD12 ' A' ' 20' ' ' LEU . 10.0 mp -46.95 147.95 2.08 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.473 -178.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.06 152.57 62.7 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.369 2.046 . . . . 0.0 112.214 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 68.7 t -130.22 130.2 65.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.517 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -105.37 152.62 22.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.596 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.494 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -116.56 145.1 43.6 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.476 178.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -123.29 124.62 43.39 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.837 0.351 . . . . 0.0 111.234 -179.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -134.14 134.75 42.55 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.805 178.146 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 . . . . . 0 N--CA 1.465 0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.687 -179.36 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 . . . . . 0 CA--C 1.515 -0.402 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -114.86 104.35 11.85 Favored 'General case' 0 CA--C 1.506 -0.737 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.789 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -101.76 107.25 18.4 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.065 0.46 . . . . 0.0 110.599 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.494 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 50.9 t -109.55 124.25 50.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.967 -179.491 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -105.24 149.95 25.55 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.476 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.3 p -119.7 119.32 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 120.913 0.387 . . . . 0.0 110.025 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 96.4 m -95.67 121.93 37.9 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.12 179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.482 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 5.3 t80 -143.07 137.38 29.15 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.36 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.483 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 12.0 p 42.19 42.83 2.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.829 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 66.16 32.35 82.01 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.436 -0.666 . . . . 0.0 111.436 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.419 ' N ' ' O ' ' A' ' 42' ' ' PHE . 29.0 mm100 -136.46 130.87 33.25 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.66 0.266 . . . . 0.0 110.357 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 61.8 p -110.04 107.59 17.51 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.221 -179.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.427 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 52.3 m-85 -94.14 141.06 28.97 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.966 179.588 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -154.26 148.03 25.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.481 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.6 p -85.31 168.21 14.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.464 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.9 p -93.83 -0.61 55.71 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.544 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -120.88 153.28 37.38 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.044 0.449 . . . . 0.0 110.344 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.686 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -103.94 134.69 46.81 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.813 -179.488 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.49 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -86.27 147.99 46.17 Favored Pre-proline 0 C--N 1.306 -1.318 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.579 -179.695 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.41 -4.63 15.28 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.704 2.269 . . . . 0.0 112.433 179.207 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -136.09 154.73 50.92 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.079 0.466 . . . . 0.0 111.22 -179.37 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.17 -62.62 1.43 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.312 -178.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.41 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 98.8 mttt -55.39 -34.46 64.37 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.756 0.312 . . . . 0.0 110.658 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 39.4 m -54.48 -35.94 63.61 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.454 -0.498 . . . . 0.0 109.925 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.477 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -72.17 -43.71 64.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.408 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -63.76 -44.27 93.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.645 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.41 ' CD2' ' O ' ' A' ' 57' ' ' LYS . 89.3 m-70 -64.04 -49.19 73.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.627 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.93 -35.2 79.96 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.611 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.15 -41.43 83.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.261 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.28 -34.59 78.34 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.625 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -53.87 -47.58 70.91 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.508 0.194 . . . . 0.0 110.907 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.403 HG12 ' H ' ' A' ' 66' ' ' ILE . 25.8 pt -74.35 -27.93 22.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.583 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.58 -51.15 30.3 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.914 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.0 p -63.27 -30.67 50.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.425 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.9 -35.1 76.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.862 0.363 . . . . 0.0 110.794 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.427 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 17.7 m . . . . . 0 C--N 1.331 -0.232 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.668 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 33.2 m . . . . . 0 N--CA 1.452 -0.371 0 CA-C-O 120.593 0.235 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.66 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 3.2 m-85 -59.31 -44.21 92.58 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.759 -178.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -58.45 -43.53 88.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.413 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -72.79 -24.38 76.18 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 69.7 tp60 -77.13 -48.77 16.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.946 0.403 . . . . 0.0 111.087 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.4 HD23 ' OH ' ' A' ' 23' ' ' TYR . 58.8 tp -61.75 -41.45 97.7 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.291 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -62.85 -40.82 98.64 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.743 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.98 -38.18 79.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.553 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 86.0 t80 -62.0 -51.75 66.78 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.665 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.511 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -58.19 -46.22 86.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.416 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.6 tp -62.26 -47.2 85.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.729 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -66.19 -36.44 83.1 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.627 -179.165 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 61.8 m80 -92.05 -3.2 56.09 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.711 -179.671 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.511 ' N ' ' O ' ' A' ' 13' ' ' ALA . 97.4 m-20 56.76 66.01 1.27 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.698 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 70.1 mt -125.31 145.39 50.04 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.988 0.423 . . . . 0.0 110.48 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.644 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 1.3 pm0 -41.04 134.96 1.89 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.183 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.8 mt -47.31 143.37 5.17 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.973 -179.006 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -73.06 153.41 52.07 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 122.37 2.047 . . . . 0.0 111.989 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.4 t -129.65 130.62 66.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.413 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.4 ' OH ' HD23 ' A' ' 9' ' ' LEU . 33.6 m-85 -107.02 153.01 23.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.718 179.56 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.504 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -115.47 146.39 41.7 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.326 178.647 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -123.97 124.16 41.98 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.062 0.458 . . . . 0.0 111.357 -179.342 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -134.86 129.34 34.27 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.344 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.0 ttt-85 . . . . . 0 CA--C 1.519 -0.248 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.532 -179.419 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 84.8 mtm-85 . . . . . 0 CA--C 1.516 -0.336 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -114.23 104.05 11.7 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.949 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -102.87 105.84 16.3 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.504 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 52.6 t -109.21 124.55 51.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.398 -179.389 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -105.43 150.02 25.64 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.919 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.463 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.1 p -120.9 119.69 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 CA-C-O 121.036 0.446 . . . . 0.0 110.243 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 96.4 m -97.23 120.48 37.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.506 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.556 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 5.1 t80 -141.68 137.8 32.01 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.266 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.556 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 3.9 m 45.32 37.32 2.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.716 179.627 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 69.68 32.62 70.84 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 111.25 -0.74 . . . . 0.0 111.25 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -135.99 125.11 24.44 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 39.9 p -105.78 107.33 18.27 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.105 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -92.5 141.07 28.92 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.019 179.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -150.49 152.3 34.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.325 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 73.2 m -95.42 160.56 14.47 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.532 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.8 m -87.2 -7.1 58.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.713 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.537 ' N ' ' OE1' ' A' ' 51' ' ' GLU . 56.3 mp0 -115.26 151.86 33.75 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.271 0.558 . . . . 0.0 110.237 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.691 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -103.53 133.7 48.12 Favored 'General case' 0 CA--C 1.505 -0.75 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.01 -179.219 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.46 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -86.19 147.16 44.28 Favored Pre-proline 0 C--N 1.308 -1.236 0 CA-C-N 114.118 -1.401 . . . . 0.0 110.831 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.84 -5.13 16.08 Favored 'Trans proline' 0 N--CA 1.498 1.756 0 C-N-CA 122.792 2.328 . . . . 0.0 112.581 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.07 155.42 50.77 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.141 0.496 . . . . 0.0 111.002 -179.379 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.68 -64.68 0.81 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.569 -178.795 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -53.11 -33.45 52.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.894 0.378 . . . . 0.0 110.657 -178.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.2 m -57.26 -35.05 69.26 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.047 179.551 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.3 -41.22 70.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.27 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -62.31 -40.25 95.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.38 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.66 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -64.66 -51.17 63.95 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.204 0.526 . . . . 0.0 110.501 179.74 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.549 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -65.71 -35.73 81.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.595 -178.774 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.91 -48.91 79.78 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.492 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.36 -32.91 73.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.733 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -54.93 -45.86 74.88 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.851 0.357 . . . . 0.0 111.34 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.2 pt -73.74 -33.51 38.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.986 0.422 . . . . 0.0 110.548 179.597 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.83 -50.0 47.02 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.125 0.488 . . . . 0.0 111.64 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.2 p -64.56 -31.11 52.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.407 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.51 -30.2 68.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.722 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.1 t . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.805 179.823 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.4 m . . . . . 0 N--CA 1.452 -0.361 0 CA-C-O 120.619 0.247 . . . . 0.0 110.399 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -58.45 -44.15 89.12 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 120.805 0.336 . . . . 0.0 110.722 -179.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -58.98 -37.05 75.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.527 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.52 -26.26 59.47 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.1 mm-40 -78.66 -50.77 10.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.985 0.421 . . . . 0.0 111.091 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 35.7 tp -61.44 -42.78 99.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.582 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -63.15 -40.67 98.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.814 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.86 -37.35 79.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.385 179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -61.74 -50.01 74.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.769 -179.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.467 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.91 -47.71 79.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.942 0.401 . . . . 0.0 110.584 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.3 tp -61.6 -45.4 94.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.548 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -66.2 -41.81 89.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.649 -179.065 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.474 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 66.3 t-80 -86.52 -5.05 59.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.565 -179.553 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.467 ' N ' ' O ' ' A' ' 13' ' ' ALA . 44.4 t-20 60.49 65.83 1.01 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.584 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.7 mt -125.34 147.83 48.98 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.868 0.366 . . . . 0.0 110.393 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -45.41 134.37 6.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.033 0.444 . . . . 0.0 110.272 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.5 mt -46.06 143.85 3.27 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.739 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -73.0 155.44 52.8 Favored 'Trans proline' 0 C--N 1.309 -1.531 0 C-N-CA 122.733 2.289 . . . . 0.0 112.086 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.4 t -129.53 132.38 66.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.466 179.143 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -108.88 153.59 23.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.692 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.51 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -116.19 141.17 48.49 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.823 178.322 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -119.76 125.53 48.84 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.026 0.441 . . . . 0.0 110.966 -179.138 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -135.09 125.86 27.26 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.769 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 . . . . . 0 C--O 1.233 0.215 0 CA-C-O 120.954 0.407 . . . . 0.0 110.388 -179.457 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 . . . . . 0 CA--C 1.516 -0.362 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -114.11 103.89 11.57 Favored 'General case' 0 C--O 1.216 -0.706 0 C-N-CA 120.338 -0.545 . . . . 0.0 111.162 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.477 ' NH2' ' OE1' ' A' ' 48' ' ' GLN . 79.5 mtp85 -104.94 104.95 14.8 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.51 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 53.7 t -110.08 128.3 55.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.42 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -108.29 152.36 24.73 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.128 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.4 HG13 ' O ' ' A' ' 40' ' ' VAL . 2.7 p -121.06 120.46 62.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.074 0.464 . . . . 0.0 110.285 -179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 54.1 m -98.85 119.31 37.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.554 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -143.05 136.24 28.17 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.369 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.47 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 42.6 t 52.21 33.63 12.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.607 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 70.33 33.9 68.66 Favored Glycine 0 CA--C 1.522 0.488 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -139.09 125.4 20.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.836 0.35 . . . . 0.0 110.338 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 33.1 m -105.48 109.79 21.89 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.046 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -95.54 141.15 29.4 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.847 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.477 ' OE1' ' NH2' ' A' ' 37' ' ' ARG . 7.1 tt0 -144.58 147.96 33.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.933 0.397 . . . . 0.0 110.42 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.423 ' OG ' ' O ' ' A' ' 51' ' ' GLU . 9.3 p -84.63 161.83 19.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.523 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 91.5 p -88.61 -6.75 57.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.554 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.423 ' O ' ' OG ' ' A' ' 49' ' ' SER . 98.8 mt-10 -122.5 157.05 32.85 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.083 0.468 . . . . 0.0 110.355 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.69 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -105.01 139.22 40.02 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.613 0.721 . . . . 0.0 110.036 -179.271 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.466 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -91.4 147.77 36.12 Favored Pre-proline 0 C--N 1.308 -1.198 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.75 -179.668 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.81 -5.3 16.27 Favored 'Trans proline' 0 C--N 1.312 -1.388 0 C-N-CA 122.838 2.359 . . . . 0.0 112.4 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.447 HG22 ' N ' ' A' ' 56' ' ' LEU . 44.1 m -132.61 155.78 48.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.266 0.555 . . . . 0.0 110.729 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.447 ' N ' HG22 ' A' ' 55' ' ' THR . 0.9 OUTLIER -69.86 -64.92 0.79 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.122 -178.676 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -52.02 -37.26 52.78 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.587 -177.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.433 ' OG ' ' O ' ' A' ' 55' ' ' THR . 78.0 p -55.0 -33.08 62.29 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 123.429 0.455 . . . . 0.0 110.382 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.47 -40.9 66.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.823 0.344 . . . . 0.0 110.925 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -64.47 -40.4 95.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.383 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -68.17 -46.08 71.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.752 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.92 -39.64 83.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.848 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.19 -48.95 79.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.728 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.32 -36.79 78.73 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.404 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -58.06 -47.7 82.36 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 86.3 mt -58.15 -47.32 87.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.318 -179.088 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.76 -44.94 76.31 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.587 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.5 t -58.54 -42.5 84.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.048 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.99 -25.97 68.37 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.539 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 6.3 t . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.633 -179.971 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.6 m . . . . . 0 N--CA 1.453 -0.283 0 CA-C-O 120.489 0.185 . . . . 0.0 110.895 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.651 ' CE2' ' ND1' ' A' ' 61' ' ' HIS . 17.6 m-85 -43.12 -64.79 0.57 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.88 0.371 . . . . 0.0 111.243 -179.354 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -50.83 -36.57 38.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.577 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -66.62 -36.69 91.72 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.916 -0.873 . . . . 0.0 110.916 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.8 tp60 -77.85 -49.2 14.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.988 0.423 . . . . 0.0 111.241 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 39.1 tp -60.06 -41.96 93.46 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.189 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -63.82 -41.93 97.76 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.912 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.45 -37.3 77.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.635 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.622 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 92.0 t80 -61.36 -53.56 55.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.982 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.436 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.47 -50.53 71.48 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.115 0.483 . . . . 0.0 110.653 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.52 -43.52 98.62 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.137 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -65.32 -39.26 92.21 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.584 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.622 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 60.3 m80 -89.72 -4.63 57.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.548 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.436 ' N ' ' O ' ' A' ' 13' ' ' ALA . 62.8 t30 62.36 67.13 0.74 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.521 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.3 mt -129.17 147.65 51.04 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 120.872 0.368 . . . . 0.0 110.642 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -44.18 137.52 3.41 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.192 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.9 mt -50.23 144.1 11.93 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.073 -179.073 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -70.64 151.53 64.13 Favored 'Trans proline' 0 C--N 1.312 -1.344 0 C-N-CA 122.322 2.015 . . . . 0.0 111.881 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 68.1 t -127.7 130.47 70.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.118 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -105.28 153.18 21.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.67 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.456 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -118.0 143.86 46.04 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.416 178.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -120.48 127.35 52.14 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.832 0.349 . . . . 0.0 111.207 -179.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -137.85 130.49 29.67 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.794 178.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 . . . . . 0 CA--C 1.517 -0.309 0 CA-C-O 120.811 0.338 . . . . 0.0 110.452 -179.523 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 . . . . . 0 CA--C 1.513 -0.469 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -114.07 103.4 11.09 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.167 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 90.9 mtm180 -99.73 106.48 18.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.15 0.5 . . . . 0.0 109.867 -179.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.456 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 45.0 t -110.63 122.29 47.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.358 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -105.24 152.78 22.45 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.839 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.469 ' O ' HG13 ' A' ' 40' ' ' VAL . 5.0 p -121.48 120.1 60.89 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.282 0 CA-C-O 121.111 0.482 . . . . 0.0 110.246 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 94.8 m -95.18 121.69 37.08 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.107 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.42 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.1 t80 -140.73 136.25 32.36 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.803 0.335 . . . . 0.0 110.441 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 14.2 m 43.94 32.06 0.58 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.896 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.02 33.82 44.19 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 42' ' ' PHE . 86.5 mt-30 -136.69 122.97 20.56 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 29.8 p -103.32 108.23 19.38 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.895 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -90.97 140.28 29.98 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.768 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -143.12 144.64 32.3 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.426 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 39.3 t -87.4 159.97 18.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.493 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 86.4 p -89.7 -5.82 56.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.682 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -117.81 153.26 33.78 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.18 0.514 . . . . 0.0 110.052 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.67 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -103.46 133.21 48.89 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-O 121.856 0.836 . . . . 0.0 109.917 -179.289 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.428 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -87.64 145.93 38.18 Favored Pre-proline 0 C--N 1.311 -1.099 0 CA-C-N 114.045 -1.434 . . . . 0.0 110.748 179.879 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -76.38 -5.46 16.18 Favored 'Trans proline' 0 N--CA 1.496 1.623 0 C-N-CA 122.735 2.29 . . . . 0.0 112.433 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.1 p -136.21 155.89 49.47 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.027 0.441 . . . . 0.0 110.9 -179.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.15 -64.18 0.91 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.108 -178.656 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -52.7 -34.16 50.88 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.536 -177.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.6 m -56.48 -36.02 68.64 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.274 179.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.42 -38.4 71.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.03 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.33 -43.94 96.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.526 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.651 ' ND1' ' CE2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -61.71 -50.23 73.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.171 0.51 . . . . 0.0 110.588 179.826 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.58 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -66.82 -36.06 81.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.632 -179.134 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.72 -47.95 82.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.685 -179.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.415 ' O ' HG23 ' A' ' 68' ' ' VAL . . . -68.39 -32.51 72.62 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.594 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -58.79 -53.89 53.3 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.07 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.41 HG13 ' N ' ' A' ' 67' ' ' ALA . 13.6 pt -58.6 -44.6 89.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.44 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.41 ' N ' HG13 ' A' ' 66' ' ' ILE . . . -67.7 -45.03 76.3 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.984 0.421 . . . . 0.0 110.402 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 64' ' ' ALA . 16.1 t -60.35 -42.56 91.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.65 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.08 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.2 -27.45 68.99 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.458 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.514 179.646 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.8 m . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 120.7 0.286 . . . . 0.0 110.709 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -60.66 -40.97 94.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.878 0.37 . . . . 0.0 110.607 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -58.74 -40.5 84.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.544 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -70.77 -25.44 75.72 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 96.4 mm-40 -77.35 -48.62 16.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.193 0.52 . . . . 0.0 111.297 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.445 HD23 ' OH ' ' A' ' 23' ' ' TYR . 44.7 tp -62.55 -42.08 99.31 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.367 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -64.07 -42.25 97.06 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.724 -179.13 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.03 -36.82 78.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.374 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.605 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 91.2 t80 -61.73 -51.07 69.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.794 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.506 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -57.58 -48.02 80.53 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.01 0.433 . . . . 0.0 110.369 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.1 tp -62.74 -44.77 95.34 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.529 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -64.98 -38.97 92.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.689 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.605 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 64.6 m80 -93.09 -1.23 56.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.614 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.506 ' N ' ' O ' ' A' ' 13' ' ' ALA . 81.9 m-20 55.92 65.29 1.48 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.532 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.2 mt -122.02 149.49 43.43 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.03 0.443 . . . . 0.0 110.326 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.515 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 55.6 mp0 -41.3 151.54 0.07 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.579 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.487 HD22 ' N ' ' A' ' 20' ' ' LEU . 3.5 mm? -61.54 137.74 94.86 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.914 -178.664 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.28 154.54 56.46 Favored 'Trans proline' 0 C--N 1.317 -1.101 0 C-N-CA 122.069 1.846 . . . . 0.0 112.004 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 68.6 t -133.17 134.87 57.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.537 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.445 ' OH ' HD23 ' A' ' 9' ' ' LEU . 29.5 m-85 -111.88 152.1 28.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.898 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.491 ' HB3' ' H ' ' A' ' 39' ' ' ASN . . . -109.84 144.78 37.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.079 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -127.08 120.34 28.72 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.915 0.388 . . . . 0.0 111.354 -179.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -133.45 127.66 33.8 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 . . . . . 0 CA--C 1.515 -0.384 0 CA-C-O 120.719 0.295 . . . . 0.0 110.378 -179.472 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 87.9 mtm-85 . . . . . 0 CA--C 1.512 -0.5 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -114.51 103.83 11.42 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 120.146 -0.622 . . . . 0.0 110.977 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.514 HH12 ' C ' ' A' ' 50' ' ' SER . 33.7 mmt180 -104.38 105.29 15.36 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.29 0.566 . . . . 0.0 110.03 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 74.1 m -114.23 134.18 55.1 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.309 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.491 ' H ' ' HB3' ' A' ' 24' ' ' ALA . 59.6 m-20 -110.14 157.89 18.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.353 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 p -122.42 120.75 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-O 121.202 0.525 . . . . 0.0 110.108 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 52.0 m -102.73 119.86 39.57 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.439 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.516 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.4 t80 -143.91 138.54 28.62 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.183 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.451 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 48.7 t 42.62 32.77 0.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.811 0.338 . . . . 0.0 110.909 179.774 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.27 30.27 59.0 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.516 ' N ' ' O ' ' A' ' 42' ' ' PHE . 99.1 mm-40 -125.19 119.23 27.95 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.817 0.342 . . . . 0.0 110.245 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 26.3 p -109.78 100.73 9.69 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.555 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -107.85 143.24 36.72 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.417 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.43 ' OE1' ' OD1' ' A' ' 39' ' ' ASN . 18.0 pt20 -153.52 154.04 33.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.772 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.3 p -82.35 162.21 22.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.403 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.514 ' C ' HH12 ' A' ' 37' ' ' ARG . 91.2 p -92.11 -3.11 56.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.577 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -109.77 153.28 24.57 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.239 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.629 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 1.0 OUTLIER -102.23 122.85 45.0 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 121.735 0.779 . . . . 0.0 109.923 -179.228 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.409 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.6 OUTLIER -78.34 148.98 75.05 Favored Pre-proline 0 C--N 1.306 -1.303 0 CA-C-N 114.144 -1.389 . . . . 0.0 110.748 -179.847 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -77.72 -6.48 16.12 Favored 'Trans proline' 0 N--CA 1.493 1.466 0 C-N-CA 122.628 2.218 . . . . 0.0 112.35 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -136.11 153.52 51.28 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.981 0.42 . . . . 0.0 110.384 -179.308 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.64 -60.32 3.48 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.007 -179.231 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -55.02 -34.09 63.19 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.927 -177.621 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.9 m -57.13 -35.88 70.01 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.206 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.53 -47.81 52.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.813 0.339 . . . . 0.0 111.283 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -62.56 -42.1 99.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.356 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -66.32 -45.74 79.27 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.683 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.45 -38.35 84.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.714 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.72 -48.0 82.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.552 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.452 ' O ' HG12 ' A' ' 68' ' ' VAL . . . -58.4 -38.69 77.86 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.402 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -55.12 -43.21 73.88 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.007 0.432 . . . . 0.0 110.107 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 62.4 mt -68.13 -42.95 85.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.439 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.413 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -65.48 -49.31 69.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.032 0.444 . . . . 0.0 111.657 -178.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.452 HG12 ' O ' ' A' ' 64' ' ' ALA . 8.8 p -67.25 -29.02 44.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.369 -179.495 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.8 -27.42 62.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.825 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 83.6 p . . . . . 0 C--N 1.331 -0.231 0 CA-C-O 121.051 0.453 . . . . 0.0 110.522 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 15.3 m . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.733 0.301 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.657 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 4.3 m-85 -61.27 -42.54 98.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.738 -179.221 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -59.35 -42.66 92.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.372 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.44 -24.29 63.43 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 111.229 -0.748 . . . . 0.0 111.229 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -76.92 -48.61 17.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.0 0.428 . . . . 0.0 110.938 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 33.6 tp -62.95 -41.52 99.53 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.09 -179.238 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -62.01 -41.75 98.4 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 119.701 -0.8 . . . . 0.0 110.614 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.61 -36.4 80.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.631 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.621 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 76.2 t80 -61.25 -51.18 70.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.596 -179.35 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.76 -48.96 76.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.084 0.468 . . . . 0.0 110.23 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.1 tp -62.68 -43.81 97.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.462 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -64.0 -40.31 96.08 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.626 -179.045 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 62.8 m80 -90.56 -4.94 56.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.63 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.476 ' N ' ' O ' ' A' ' 13' ' ' ALA . 63.3 t30 62.98 66.62 0.73 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.611 179.547 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.7 mt -127.67 148.3 50.39 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.457 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -45.78 136.94 5.8 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.932 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.0 mt -47.31 143.89 4.81 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.993 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -72.66 155.92 53.91 Favored 'Trans proline' 0 N--CA 1.494 1.509 0 C-N-CA 122.465 2.11 . . . . 0.0 112.016 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 74.9 t -129.58 130.34 67.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.445 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -106.55 152.4 23.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.333 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.453 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -113.68 145.86 40.69 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.388 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -125.02 121.96 35.89 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.742 0.306 . . . . 0.0 111.146 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -131.77 129.4 40.52 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 177.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.6 ttt-85 . . . . . 0 CA--C 1.516 -0.356 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.484 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 . . . . . 0 CA--C 1.516 -0.337 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -114.89 104.15 11.64 Favored 'General case' 0 CA--C 1.508 -0.642 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.187 179.491 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.8 mtp180 -100.52 105.94 17.43 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.674 -0.41 . . . . 0.0 109.9 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.453 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 44.1 t -110.63 125.26 53.24 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 120.96 0.41 . . . . 0.0 110.37 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -108.02 155.62 20.15 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.152 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.457 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.3 p -123.27 120.04 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.086 0.47 . . . . 0.0 110.347 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 95.4 m -97.92 119.27 36.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.233 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.491 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 5.3 t80 -140.07 139.44 35.9 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.337 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.491 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 6.2 m 44.11 32.25 0.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.6 32.32 54.67 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.496 -0.642 . . . . 0.0 111.496 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 42' ' ' PHE . 84.7 mt-30 -134.75 120.69 19.74 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.766 0.317 . . . . 0.0 110.253 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.2 m -102.72 107.68 18.65 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 121.02 0.438 . . . . 0.0 110.885 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -91.16 141.12 29.15 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.157 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -142.71 139.11 30.99 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.522 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.9 p -81.77 162.69 22.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.436 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.9 m -90.63 -9.24 47.69 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.732 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -120.99 142.37 49.85 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.266 0.555 . . . . 0.0 110.602 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.573 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.0 140.19 29.9 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.956 -179.368 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.411 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -92.33 147.93 35.49 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 114.711 -1.131 . . . . 0.0 111.12 -179.701 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -77.03 -4.61 15.07 Favored 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 122.807 2.338 . . . . 0.0 112.582 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.02 154.29 51.24 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.243 0.544 . . . . 0.0 111.143 -179.194 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.67 -64.86 0.78 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.632 -178.676 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -56.1 -35.45 67.04 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 120.731 0.301 . . . . 0.0 110.567 -177.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 40.2 t -56.45 -34.19 66.62 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.986 179.366 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.88 -39.46 79.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.27 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -62.43 -41.73 98.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.6 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.657 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -62.01 -52.17 65.06 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.162 0.506 . . . . 0.0 110.446 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.567 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -64.97 -37.24 86.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.743 -178.678 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.59 -45.46 91.81 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.437 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.482 ' O ' HG23 ' A' ' 68' ' ' VAL . . . -68.16 -34.09 75.67 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.906 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -59.35 -52.8 64.08 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 121.092 -0.243 . . . . 0.0 111.421 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.403 HG13 ' N ' ' A' ' 67' ' ' ALA . 12.4 pt -57.82 -45.57 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.124 -179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.403 ' N ' HG13 ' A' ' 66' ' ' ILE . . . -66.88 -43.36 83.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.083 0.468 . . . . 0.0 110.659 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 64' ' ' ALA . 18.4 t -60.6 -42.71 92.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.064 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.67 -27.72 69.42 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.696 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.4 m . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.818 -179.946 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.8 m . . . . . 0 N--CA 1.456 -0.148 0 CA-C-O 121.013 0.435 . . . . 0.0 110.738 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -60.91 -44.52 97.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.653 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -59.83 -42.55 93.8 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.598 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.47 -34.92 91.2 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -74.99 -44.51 47.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.063 0.459 . . . . 0.0 111.053 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.453 HD23 ' OH ' ' A' ' 23' ' ' TYR . 49.1 tp -62.97 -40.79 98.78 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.199 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -66.29 -40.06 89.8 Favored 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 119.901 -0.72 . . . . 0.0 110.785 -179.566 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.28 -40.15 89.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.449 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -62.91 -48.18 80.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.67 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.71 -40.27 62.84 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.381 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.3 tp -63.49 -44.84 93.2 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.429 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.6 tp60 -70.29 -41.01 73.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.989 0.424 . . . . 0.0 111.122 -178.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.463 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 58.7 t-80 -74.0 -14.0 60.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.608 -179.579 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 54.83 69.0 0.78 Allowed 'General case' 0 C--O 1.233 0.198 0 C-N-CA 120.886 -0.325 . . . . 0.0 111.762 178.546 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -147.07 169.45 19.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.316 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -43.37 131.37 4.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.183 178.009 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.498 ' N ' HD12 ' A' ' 20' ' ' LEU . 10.9 mp -53.94 152.35 10.54 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.717 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -66.82 148.61 82.77 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 C-N-CA 122.447 2.098 . . . . 0.0 112.085 179.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 75.0 t -132.84 132.2 59.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.561 179.32 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.453 ' OH ' HD23 ' A' ' 9' ' ' LEU . 32.1 m-85 -107.99 151.32 25.98 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.468 179.376 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -126.16 131.96 51.92 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.047 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -112.65 137.61 50.67 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.854 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -139.84 150.39 44.61 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.6 ttt-85 . . . . . 0 CA--C 1.515 -0.366 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 -179.803 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 . . . . . 0 CA--C 1.516 -0.343 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -112.49 105.17 13.34 Favored 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 120.565 -0.454 . . . . 0.0 111.648 -178.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 -101.4 108.65 20.31 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 62.0 m -115.01 143.67 44.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.921 0.391 . . . . 0.0 110.633 -179.538 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.527 ' ND2' ' OE1' ' A' ' 48' ' ' GLN . 8.6 m-20 -116.36 157.52 24.91 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.949 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.452 ' O ' HG13 ' A' ' 40' ' ' VAL . 3.7 p -124.31 121.06 60.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.928 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 64.7 m -96.37 124.67 40.45 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.622 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.478 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.1 t80 -146.35 139.64 25.8 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.238 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.495 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 42.9 t 42.99 32.79 0.45 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.915 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 74.98 28.06 63.26 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 42' ' ' PHE . 87.0 mt-30 -131.32 130.85 43.27 Favored 'General case' 0 C--O 1.233 0.211 0 O-C-N 122.724 -0.28 . . . . 0.0 110.42 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 63.6 p -108.76 104.63 13.95 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.968 0.414 . . . . 0.0 110.879 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -89.83 140.68 29.37 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.964 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.527 ' OE1' ' ND2' ' A' ' 39' ' ' ASN . 27.4 mt-30 -141.01 154.77 46.16 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.313 -179.719 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 42.8 m -100.45 157.78 16.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.52 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.9 t -89.53 -2.6 58.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.718 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -116.85 136.34 53.03 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.268 0.556 . . . . 0.0 110.308 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.579 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.68 144.95 24.81 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.71 -179.578 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.55 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -105.97 148.05 35.86 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 114.623 -1.171 . . . . 0.0 111.085 179.783 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.87 -3.54 13.61 Favored 'Trans proline' 0 N--CA 1.5 1.891 0 C-N-CA 122.938 2.425 . . . . 0.0 112.64 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.429 HG22 ' N ' ' A' ' 56' ' ' LEU . 89.3 m -134.88 154.24 51.74 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.04 0.447 . . . . 0.0 111.24 -179.187 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.429 ' N ' HG22 ' A' ' 55' ' ' THR . 0.4 OUTLIER -65.19 -62.98 1.22 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.506 -178.706 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.473 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 98.5 mttt -54.1 -33.57 58.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.738 0.304 . . . . 0.0 110.593 -177.877 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.5 m -56.95 -34.71 68.29 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.434 -0.507 . . . . 0.0 110.032 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.448 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -73.1 -44.28 60.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.45 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.25 -41.92 94.23 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.741 -179.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.476 ' ND1' ' N ' ' A' ' 61' ' ' HIS . 0.3 OUTLIER -61.81 -49.67 75.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.662 -179.727 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.51 -33.75 74.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.84 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.13 -49.19 77.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.825 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.67 -31.29 70.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.625 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -54.68 -46.21 74.03 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 121.124 -0.23 . . . . 0.0 110.75 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 23.3 pt -74.92 -30.88 24.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.817 0.341 . . . . 0.0 110.654 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.94 -52.07 22.08 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.125 0.488 . . . . 0.0 111.672 -179.075 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.1 p -61.71 -31.02 49.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.355 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.04 -28.64 64.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.731 179.68 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 78.0 p . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.734 -179.845 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.0 m . . . . . 0 N--CA 1.453 -0.316 0 CA-C-O 120.58 0.228 . . . . 0.0 110.742 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -56.22 -45.76 79.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.848 0.356 . . . . 0.0 111.067 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -59.99 -41.57 92.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.579 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.84 -30.79 72.49 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.48 -0.648 . . . . 0.0 111.48 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 -76.81 -48.91 17.12 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.213 0.53 . . . . 0.0 110.631 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.2 tp -61.97 -42.59 99.31 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.507 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -65.29 -40.93 94.46 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.531 -179.15 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.76 -39.29 76.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.807 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.467 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 90.3 t80 -61.86 -49.93 74.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.151 -179.376 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.405 ' HB2' ' HZ ' ' A' ' 42' ' ' PHE . . . -55.89 -52.25 64.73 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.19 0.519 . . . . 0.0 110.592 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.68 -42.93 97.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.828 -179.413 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -53.71 -39.42 65.2 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.67 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.467 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 77.7 m80 -97.79 2.75 49.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.587 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.594 ' C ' HD12 ' A' ' 18' ' ' LEU . 62.3 t30 64.54 67.37 0.57 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.022 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.594 HD12 ' C ' ' A' ' 17' ' ' ASN . 9.5 mp -115.21 -172.97 2.23 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.545 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -91.77 139.77 30.35 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.941 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.588 ' N ' HD12 ' A' ' 20' ' ' LEU . 10.2 mp -47.53 141.9 6.7 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.03 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.98 158.19 42.42 Favored 'Trans proline' 0 N--CA 1.495 1.578 0 C-N-CA 122.87 2.38 . . . . 0.0 111.824 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.6 t -129.96 134.65 62.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.547 179.481 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -114.24 154.64 27.57 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.238 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -118.67 144.51 46.15 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.0 178.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -123.86 125.38 44.56 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.254 0.55 . . . . 0.0 111.162 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -134.39 127.75 32.23 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.221 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 . . . . . 0 CA--C 1.516 -0.336 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.187 -179.455 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 . . . . . 0 CA--C 1.512 -0.515 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -113.86 104.16 11.91 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.756 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -103.58 105.82 16.16 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.108 0.48 . . . . 0.0 109.978 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 69.4 m -115.28 133.39 56.08 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.119 0.485 . . . . 0.0 111.26 -179.27 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -110.27 153.36 24.95 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.522 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.473 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.2 p -120.48 119.83 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.316 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.6 m -97.32 119.64 36.21 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.377 179.534 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.405 ' HZ ' ' HB2' ' A' ' 13' ' ' ALA . 7.2 t80 -143.18 139.63 30.41 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.462 -179.619 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.423 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 49.5 t 47.98 32.28 2.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.842 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.99 31.38 61.98 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -137.43 132.68 33.76 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 40.9 p -108.71 107.01 17.3 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.032 -179.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.42 ' HZ ' ' HG ' ' A' ' 70' ' ' SER . 48.0 m-85 -93.1 140.88 29.03 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.885 179.743 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -151.5 146.9 26.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.337 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.0 p -85.57 164.31 17.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.695 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.0 p -90.24 -2.02 57.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.833 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -124.45 143.19 50.77 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.407 0.623 . . . . 0.0 110.808 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.644 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -91.45 143.14 26.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.54 -179.33 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.513 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -96.2 149.29 35.73 Favored Pre-proline 0 C--N 1.318 -0.8 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.132 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -77.23 -3.59 13.86 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 123.182 2.588 . . . . 0.0 112.752 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.424 ' O ' ' OG ' ' A' ' 58' ' ' SER . 0.8 OUTLIER -134.31 155.9 49.41 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.238 0.542 . . . . 0.0 110.757 -179.508 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.4 -66.01 0.65 Allowed 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.493 -178.422 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -53.22 -34.19 56.01 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.603 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.424 ' OG ' ' O ' ' A' ' 55' ' ' THR . 77.4 p -57.63 -33.27 68.09 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.579 179.717 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.41 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -71.11 -40.87 71.22 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.941 0.401 . . . . 0.0 110.888 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -65.37 -40.32 93.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.402 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 27.7 m170 -62.98 -50.31 71.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.749 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.25 -34.46 78.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.761 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.32 -46.35 86.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.598 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.77 -33.67 75.29 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.823 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 53.9 tttp -54.11 -46.03 72.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.587 0.232 . . . . 0.0 110.845 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.2 pt -74.84 -29.55 22.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.679 179.344 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.89 -51.49 25.88 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.471 -179.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.0 p -63.36 -29.01 46.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.281 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.82 -31.22 67.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 0.0 110.68 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.42 ' HG ' ' HZ ' ' A' ' 47' ' ' PHE . 37.1 t . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.675 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 31.3 m . . . . . 0 N--CA 1.454 -0.268 0 CA-C-O 120.863 0.363 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.523 ' CE1' ' NE2' ' A' ' 61' ' ' HIS . 4.4 m-85 -53.58 -45.02 69.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.792 -179.103 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -62.12 -41.09 97.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.637 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.48 -30.36 56.7 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.249 -0.741 . . . . 0.0 111.249 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -75.63 -47.32 26.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.808 0.337 . . . . 0.0 111.106 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 35.0 tp -61.56 -43.13 99.43 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.385 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -64.25 -41.52 96.92 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.836 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.06 -36.96 78.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.584 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.631 ' CE2' ' CE1' ' A' ' 16' ' ' HIS . 50.0 t80 -59.73 -50.69 72.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.823 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.4 -48.34 77.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.489 179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 47.7 tp -62.02 -43.71 98.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.611 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -63.69 -39.3 93.98 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.712 -179.387 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.631 ' CE1' ' CE2' ' A' ' 12' ' ' TYR . 57.8 m80 -89.36 2.48 54.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.549 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 61.6 t30 60.0 61.66 1.83 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.526 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.8 mt -131.2 148.52 52.71 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.599 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -48.29 134.67 14.48 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.016 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.556 ' N ' HD12 ' A' ' 20' ' ' LEU . 10.1 mp -48.51 150.02 2.6 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.858 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.92 152.57 63.43 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 C-N-CA 122.587 2.191 . . . . 0.0 111.934 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 79.6 t -129.2 128.76 67.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.415 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -104.82 152.49 22.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.402 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.532 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -126.0 132.68 51.97 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.207 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -110.39 136.44 49.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.956 0.407 . . . . 0.0 110.882 -178.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -139.74 149.69 43.91 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.022 179.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 . . . . . 0 C--O 1.232 0.161 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.762 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 . . . . . 0 CA--C 1.515 -0.397 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -111.49 106.84 15.85 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-O 121.203 0.525 . . . . 0.0 111.938 -179.049 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -100.28 108.28 20.3 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.532 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 35.3 t -111.74 134.5 53.27 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.834 -179.169 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -112.54 157.58 20.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.225 179.634 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.465 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.9 p -122.49 120.57 61.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-O 120.87 0.367 . . . . 0.0 110.277 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 93.8 m -95.66 121.17 37.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.562 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -144.1 132.28 21.8 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.019 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.476 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 44.9 t 49.43 32.21 4.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.904 0.383 . . . . 0.0 110.878 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.03 31.54 57.65 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 111.467 -0.653 . . . . 0.0 111.467 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -134.31 128.86 34.6 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 76.2 p -107.73 106.87 17.38 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.027 -179.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -92.82 142.23 27.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.122 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -138.39 160.08 40.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.376 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.9 t -100.32 161.12 13.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.437 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.0 p -90.99 -5.94 54.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.562 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.545 ' N ' ' OE1' ' A' ' 51' ' ' GLU . 55.9 mp0 -117.72 139.89 50.41 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.114 0.483 . . . . 0.0 110.495 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.576 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.62 145.32 24.91 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.919 -179.166 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.524 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -107.9 147.19 34.99 Favored Pre-proline 0 C--N 1.315 -0.913 0 CA-C-N 115.014 -0.993 . . . . 0.0 111.065 179.763 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -77.91 -3.41 13.48 Favored 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 122.736 2.291 . . . . 0.0 112.555 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 p -134.26 153.98 51.55 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.007 0.432 . . . . 0.0 111.064 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.17 -63.76 1.01 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.275 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -52.31 -34.41 46.8 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.995 -177.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 34.6 m -57.55 -33.39 68.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.856 0.36 . . . . 0.0 110.527 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.432 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -72.74 -46.22 54.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.164 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -59.04 -34.93 72.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.432 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.523 ' NE2' ' CE1' ' A' ' 5' ' ' TYR . 2.7 t-80 -62.31 -60.01 4.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.872 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.406 ' N ' ' ND1' ' A' ' 61' ' ' HIS . . . -64.91 -34.92 79.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.772 -179.365 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.98 -52.6 65.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.955 -179.092 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.58 -39.58 80.74 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.81 -179.563 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -57.18 -48.71 78.07 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.668 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 96.7 mt -56.82 -46.99 83.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.304 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.94 -45.8 73.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.025 0.44 . . . . 0.0 110.431 179.817 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.0 t -57.04 -41.25 77.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.004 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -66.49 -27.24 67.63 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.827 0.346 . . . . 0.0 110.675 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.4 m . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.734 179.961 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.5 m . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 120.784 0.326 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.657 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 5.7 m-85 -58.24 -45.58 87.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.717 -179.185 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -59.43 -41.98 90.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.969 0.414 . . . . 0.0 110.253 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.57 -32.54 83.59 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -76.51 -47.38 22.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.007 0.432 . . . . 0.0 111.158 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.8 tp -62.2 -42.55 99.4 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.303 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -62.61 -41.4 98.97 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 119.692 -0.803 . . . . 0.0 110.691 -178.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.42 -37.39 82.98 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.572 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.617 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 63.0 t80 -61.32 -50.96 70.87 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.669 -179.497 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.77 -47.28 80.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.971 0.415 . . . . 0.0 110.266 -179.722 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.5 tp -62.16 -45.38 93.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.503 -179.21 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -65.01 -38.18 90.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.506 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.617 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 62.4 m80 -91.17 2.28 56.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.536 -179.736 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 54.53 65.04 1.61 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.686 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.5 mt -127.65 151.32 49.09 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.089 0.471 . . . . 0.0 110.567 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -47.68 139.26 7.4 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.845 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 pp -52.68 146.19 18.82 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.902 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -72.35 153.24 55.92 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 122.5 2.133 . . . . 0.0 112.119 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.5 t -129.79 131.21 66.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.523 179.226 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -106.99 152.41 24.02 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.34 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -128.18 110.72 12.7 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 178.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.448 ' OD1' ' O ' ' A' ' 25' ' ' ASN . 40.7 p30 -107.3 144.14 34.56 Favored 'General case' 0 CA--C 1.517 -0.302 0 O-C-N 123.713 0.633 . . . . 0.0 110.987 -178.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.451 ' OE1' ' N ' ' A' ' 27' ' ' ARG . 0.7 OUTLIER -145.04 148.63 33.91 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.252 178.786 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.451 ' N ' ' OE1' ' A' ' 26' ' ' GLU . 61.7 ttp180 . . . . . 0 CA--C 1.516 -0.336 0 CA-C-O 120.648 0.261 . . . . 0.0 110.432 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.9 mmt180 . . . . . 0 CA--C 1.512 -0.497 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -115.04 102.19 9.7 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.332 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 85.7 mtp180 -101.16 106.93 18.22 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 9.9 t -114.87 129.21 56.66 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.016 -179.607 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -109.39 157.79 18.57 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.665 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.477 ' O ' HG13 ' A' ' 40' ' ' VAL . 5.4 p -125.24 121.32 60.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.196 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 99.1 m -98.52 123.93 42.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.737 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -146.23 132.81 19.81 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.312 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.476 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 51.8 t 47.84 45.14 18.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.837 0.351 . . . . 0.0 110.615 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 61.7 31.55 78.41 Favored Glycine 0 CA--C 1.522 0.505 0 N-CA-C 111.244 -0.742 . . . . 0.0 111.244 179.047 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.432 ' CG ' ' CE1' ' A' ' 47' ' ' PHE . 11.9 tp-100 -136.81 123.31 20.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.843 0.354 . . . . 0.0 110.167 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.97 109.62 21.68 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.299 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.472 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 60.0 m-85 -91.99 141.04 29.05 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.971 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.468 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 2.6 pm0 -149.71 156.02 41.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.176 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.6 t -96.52 170.75 9.0 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.429 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.5 p -99.21 -0.35 41.64 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.543 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -128.23 129.69 46.8 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.187 0.518 . . . . 0.0 110.706 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.92 148.0 32.85 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.992 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.479 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -99.2 147.62 33.52 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.165 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -74.88 -6.89 18.71 Favored 'Trans proline' 0 N--CA 1.497 1.71 0 C-N-CA 122.741 2.294 . . . . 0.0 112.457 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 p -133.45 155.0 50.33 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.221 0.534 . . . . 0.0 111.095 -179.103 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.77 -64.16 0.91 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.425 -178.549 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -53.71 -33.05 54.27 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.805 0.336 . . . . 0.0 110.381 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.4 t -56.92 -36.93 70.77 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.026 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.422 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -68.8 -45.45 71.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.457 -179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.62 -39.48 84.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.29 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' HIS . . . . . 0.657 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -64.32 -52.45 58.39 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.256 0.55 . . . . 0.0 110.735 179.949 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.566 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -65.63 -36.0 82.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.111 -178.553 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.81 -49.28 78.28 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.569 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.62 -32.1 70.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.787 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -54.77 -45.37 74.23 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.675 0.274 . . . . 0.0 110.832 -179.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 23.1 pt -74.08 -34.43 38.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 120.935 0.397 . . . . 0.0 110.677 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.53 -50.63 43.22 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.032 0.444 . . . . 0.0 111.666 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.5 p -63.07 -32.38 56.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.2 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.32 -28.08 65.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.57 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.472 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 18.5 m . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.688 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.1 m . . . . . 0 N--CA 1.457 -0.081 0 CA-C-O 120.724 0.297 . . . . 0.0 110.674 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -60.33 -45.97 91.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.684 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -61.08 -45.11 96.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.458 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.0 -34.84 90.95 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -73.24 -44.57 59.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.87 0.367 . . . . 0.0 111.227 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 45.6 tp -62.92 -41.19 99.38 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.417 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -64.37 -41.24 96.82 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 119.868 -0.733 . . . . 0.0 110.515 -179.472 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.73 -37.97 82.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.991 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.613 ' CE1' ' CD2' ' A' ' 16' ' ' HIS . 71.4 t80 -61.52 -50.69 71.69 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.825 -179.338 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.418 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -55.73 -47.69 76.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.931 0.396 . . . . 0.0 110.329 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.8 tt -63.16 -43.01 99.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.979 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -64.14 -40.97 97.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.627 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.613 ' CD2' ' CE1' ' A' ' 12' ' ' TYR . 78.7 m-70 -89.49 -4.24 58.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.765 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.418 ' N ' ' O ' ' A' ' 13' ' ' ALA . 64.7 t30 61.3 65.32 0.98 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.571 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 78.9 mt -128.51 148.83 50.77 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.601 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.594 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 1.5 mp0 -47.29 147.8 1.47 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.828 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.89 145.28 53.87 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.866 -179.099 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.68 153.02 64.96 Favored 'Trans proline' 0 N--CA 1.495 1.561 0 C-N-CA 122.4 2.067 . . . . 0.0 111.772 179.67 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 64.7 t -127.67 130.69 70.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.33 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -107.45 148.69 28.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.695 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.46 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -124.65 111.39 15.56 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.598 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.502 ' OD1' ' SG ' ' A' ' 38' ' ' CYS . 45.3 m-80 -109.88 143.55 39.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.735 0.302 . . . . 0.0 110.612 -178.792 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -148.0 151.25 35.44 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 . . . . . 0 CA--C 1.515 -0.373 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.587 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 . . . . . 0 CA--C 1.519 -0.23 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -111.39 105.98 14.76 Favored 'General case' 0 CA--C 1.5 -0.97 0 C-N-CA 120.266 -0.573 . . . . 0.0 111.744 -178.515 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 40.9 mtm180 -106.13 113.18 26.56 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.61 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.502 ' SG ' ' OD1' ' A' ' 25' ' ' ASN . 43.7 t -119.16 150.94 39.19 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.245 0.545 . . . . 0.0 110.97 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -122.34 159.83 26.64 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.19 -0.913 . . . . 0.0 110.344 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.5 p -124.05 127.38 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.088 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 99.6 m -105.5 122.84 46.83 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.063 179.601 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.493 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.0 t80 -145.29 136.13 24.56 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 7.0 m 42.26 31.77 0.28 Allowed 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.057 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.83 25.92 61.55 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 120.994 -0.622 . . . . 0.0 111.653 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.493 ' N ' ' O ' ' A' ' 42' ' ' PHE . 85.3 mt-30 -120.44 124.57 45.78 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.724 0.297 . . . . 0.0 110.627 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.5 p -110.41 99.53 8.53 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.307 0.575 . . . . 0.0 111.012 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -100.3 140.6 34.32 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.211 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -145.89 148.95 33.38 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.142 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 44.0 t -87.73 161.72 17.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.378 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 79.0 p -91.6 -2.58 57.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.389 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -112.24 133.97 54.05 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.158 0.504 . . . . 0.0 110.532 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.585 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.68 144.65 25.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.648 -179.438 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.62 149.81 38.84 Favored Pre-proline 0 C--N 1.311 -1.092 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.976 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -80.4 -3.06 12.36 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 123.089 2.526 . . . . 0.0 112.666 179.303 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.77 147.69 50.42 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.327 0.584 . . . . 0.0 111.347 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.502 HD23 ' O ' ' A' ' 56' ' ' LEU . 2.1 tt -65.51 -61.51 2.06 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.865 -178.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -56.41 -35.83 68.25 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 120.795 0.331 . . . . 0.0 111.197 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 51.2 m -55.39 -33.35 63.39 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.754 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.31 -41.45 69.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.402 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.432 ' OE2' ' ND2' ' A' ' 25' ' ' ASN . 98.4 mt-10 -65.15 -41.73 94.47 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.92 -179.456 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -66.37 -45.62 79.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.052 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.01 -36.45 84.44 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.673 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.0 -40.82 86.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.184 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.405 ' O ' HG12 ' A' ' 68' ' ' VAL . . . -68.32 -33.81 74.99 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.824 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -55.22 -46.73 75.95 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.666 0.269 . . . . 0.0 111.173 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.404 HG12 ' H ' ' A' ' 66' ' ' ILE . 21.9 pt -71.85 -38.6 65.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.429 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.44 -49.28 61.03 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.405 HG12 ' O ' ' A' ' 64' ' ' ALA . 8.0 p -62.07 -31.04 50.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.886 0.374 . . . . 0.0 110.053 -179.155 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.88 -27.21 62.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.527 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 35.8 t . . . . . 0 C--N 1.332 -0.181 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.82 179.802 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.7 mmm . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.506 ' O ' ' ND1' ' A' ' 3' ' ' HIS . 44.8 p-10 -81.97 172.99 12.63 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.607 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.723 ' ND1' ' CE1' ' A' ' 61' ' ' HIS . 11.6 m-70 -138.87 57.8 1.66 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.804 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.6 m -101.24 -15.88 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.847 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -58.33 -44.56 88.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.887 0.375 . . . . 0.0 111.112 -178.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -60.07 -42.91 95.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.009 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.53 -31.84 82.22 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 111.146 -0.781 . . . . 0.0 111.146 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -76.22 -46.92 25.95 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.671 0.272 . . . . 0.0 111.415 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.429 HD23 ' OH ' ' A' ' 23' ' ' TYR . 51.0 tp -62.35 -41.32 98.49 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.435 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -64.74 -43.09 94.46 Favored 'General case' 0 N--CA 1.44 -0.95 0 C-N-CA 119.821 -0.752 . . . . 0.0 110.323 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.51 -39.06 85.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.735 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE2' ' CE1' ' A' ' 16' ' ' HIS . 55.9 t80 -62.45 -52.45 63.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.729 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.69 -49.47 76.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.82 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.7 tp -63.47 -45.24 91.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.831 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -64.71 -39.86 94.37 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.542 -178.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE2' ' A' ' 12' ' ' TYR . 72.9 m80 -86.21 -7.3 58.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.67 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 63.1 t30 62.91 66.0 0.77 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.417 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.9 mt -127.55 148.18 50.34 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.641 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -44.71 137.22 4.02 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 121.07 0.462 . . . . 0.0 109.994 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.6 mt -48.98 144.3 7.64 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.732 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.53 154.7 55.25 Favored 'Trans proline' 0 N--CA 1.495 1.607 0 C-N-CA 122.398 2.065 . . . . 0.0 111.979 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.8 t -130.04 130.63 66.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-O 121.246 0.546 . . . . 0.0 110.792 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.429 ' OH ' HD23 ' A' ' 9' ' ' LEU . 33.8 m-85 -106.9 152.89 23.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.874 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -116.6 143.74 45.24 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.547 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -121.2 124.81 45.6 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 120.691 0.281 . . . . 0.0 111.197 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -134.73 132.79 39.23 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -133.9 119.56 19.27 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -159.2 133.23 7.57 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 150.98 141.77 3.41 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.247 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_exo -43.48 166.42 0.03 OUTLIER 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 121.877 1.718 . . . . 0.0 112.55 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -54.28 -50.19 14.39 Favored 'Trans proline' 0 N--CA 1.502 1.998 0 C-N-CA 122.464 2.109 . . . . 0.0 113.013 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -88.47 4.34 46.9 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.586 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.14 61.41 20.83 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.462 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -82.08 143.24 12.72 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 C-N-CA 122.628 2.218 . . . . 0.0 111.457 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 85.9 mtt85 -132.87 131.23 40.73 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -114.48 103.34 10.94 Favored 'General case' 0 CA--C 1.501 -0.941 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.112 179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -102.76 107.17 17.95 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.522 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.414 ' O ' ' OE1' ' A' ' 48' ' ' GLN . 69.8 m -113.26 129.82 56.42 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.427 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.421 ' OD1' ' OE1' ' A' ' 48' ' ' GLN . 60.0 m-80 -105.56 150.85 25.01 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.77 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.423 ' O ' HG13 ' A' ' 40' ' ' VAL . 3.0 p -120.36 119.68 60.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 98.5 m -97.32 122.3 40.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.307 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -144.64 135.95 25.31 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.324 -0.398 . . . . 0.0 109.965 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.492 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 43.4 t 47.35 36.3 4.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.925 0.393 . . . . 0.0 110.907 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 69.56 32.11 71.09 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.332 -0.707 . . . . 0.0 111.332 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -135.17 128.27 31.73 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.731 0.301 . . . . 0.0 110.39 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 55.2 p -107.53 106.83 17.39 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.979 0.419 . . . . 0.0 111.129 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -92.72 141.71 28.16 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.039 179.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.421 ' OE1' ' OD1' ' A' ' 39' ' ' ASN . 69.9 tp60 -152.89 145.55 24.27 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.416 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 92.6 p -86.94 161.2 18.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.412 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.0 p -88.65 -4.05 58.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.895 0.378 . . . . 0.0 110.101 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -112.96 146.62 38.69 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.516 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.68 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -99.96 135.85 40.77 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 121.893 0.854 . . . . 0.0 109.538 -179.97 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.433 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -89.59 150.72 44.83 Favored Pre-proline 0 C--N 1.307 -1.259 0 CA-C-N 114.119 -1.401 . . . . 0.0 110.723 -179.544 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -79.76 -4.57 13.52 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 C-N-CA 122.496 2.13 . . . . 0.0 112.465 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.42 153.44 51.79 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.936 0.398 . . . . 0.0 111.02 -179.145 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.23 -62.82 1.32 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.657 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.536 ' HB3' ' CE1' ' A' ' 61' ' ' HIS . 63.5 mttp -55.66 -32.91 63.62 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 120.802 0.334 . . . . 0.0 110.734 -177.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.2 t -56.84 -37.79 71.76 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.829 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.14 -41.71 81.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.057 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -63.5 -44.05 95.48 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.753 0.311 . . . . 0.0 110.841 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.723 ' CE1' ' ND1' ' A' ' 3' ' ' HIS . 25.2 m170 -62.06 -48.03 82.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.394 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.52 -36.01 81.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.533 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.65 -48.19 81.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.369 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.68 -33.32 75.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.953 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -54.97 -47.33 74.69 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.614 0.245 . . . . 0.0 111.061 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.4 pt -74.08 -32.21 32.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.5 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.425 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -68.37 -50.29 54.18 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.769 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 p -65.1 -29.98 48.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.743 0.306 . . . . 0.0 110.502 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.24 -33.59 73.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.916 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.425 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 86.1 p -67.3 -38.67 85.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.956 0.408 . . . . 0.0 110.566 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 53.8 mt -67.24 -31.53 71.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.693 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 29.1 m . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.585 -179.98 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.3 mtm . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.411 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 95.9 m-20 -69.85 141.13 53.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.36 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.456 ' O ' ' CD2' ' A' ' 3' ' ' HIS . 55.7 p-80 -159.34 43.59 0.24 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.775 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.2 m -93.78 -15.29 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-O 120.737 0.303 . . . . 0.0 110.855 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -57.91 -44.82 87.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.719 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -58.1 -42.54 85.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.365 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -66.92 -29.74 75.08 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -77.22 -49.3 15.42 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.009 0.433 . . . . 0.0 111.264 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 56.2 tp -62.84 -41.82 99.5 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.445 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -64.7 -40.41 95.32 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 119.538 -0.865 . . . . 0.0 110.611 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.32 -38.32 81.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.557 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -62.13 -49.78 74.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.803 -179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.412 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -57.33 -47.88 80.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.881 0.372 . . . . 0.0 110.39 -179.518 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.2 tp -61.89 -46.2 90.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.615 -179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -65.7 -39.59 91.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.781 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.499 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 60.0 t-80 -88.37 -0.87 57.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.601 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.412 ' N ' ' O ' ' A' ' 13' ' ' ALA . 80.7 m-20 56.17 65.54 1.41 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.671 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 81.7 mt -127.07 148.87 50.13 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.413 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -46.34 134.58 8.79 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.752 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.3 mt -46.91 144.8 3.56 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.692 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.89 153.5 63.72 Favored 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 122.215 1.944 . . . . 0.0 111.878 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 73.6 t -129.83 130.43 66.52 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.339 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -106.37 152.77 23.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.41 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.474 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -117.53 140.54 49.48 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.279 178.289 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -119.47 125.66 49.44 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.962 0.41 . . . . 0.0 111.319 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -135.0 133.84 39.86 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.061 178.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 69.8 ttp85 -133.42 119.99 20.34 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.172 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -159.1 132.77 7.39 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.495 -0.482 . . . . 0.0 109.751 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 150.08 143.37 3.73 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 120.444 -0.884 . . . . 0.0 111.272 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -43.83 165.94 0.04 OUTLIER 'Trans proline' 0 N--CA 1.491 1.334 0 C-N-CA 121.914 1.743 . . . . 0.0 112.61 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.41 -51.37 11.08 Favored 'Trans proline' 0 N--CA 1.499 1.833 0 C-N-CA 122.539 2.159 . . . . 0.0 112.841 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 51.5 p-80 -88.06 5.84 39.1 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.565 -179.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.33 60.95 18.27 Favored Pre-proline 0 C--N 1.332 -0.191 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.825 178.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -81.1 142.29 13.52 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 122.668 2.245 . . . . 0.0 111.545 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 91.1 mtm180 -131.29 130.15 42.43 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -113.67 103.55 11.34 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.217 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -99.62 106.33 18.29 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.474 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 45.1 t -112.23 124.42 52.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.489 -179.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -107.77 151.58 25.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.079 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.462 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.0 p -120.59 120.03 61.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.303 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.165 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 87.2 m -96.07 121.42 37.8 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.283 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.556 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 5.0 t80 -142.18 138.99 31.93 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.189 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.556 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 4.0 m 45.25 31.98 0.9 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.743 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 74.88 32.17 57.22 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 42' ' ' PHE . 86.6 mt-30 -136.59 126.76 26.29 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 45.7 p -104.86 106.89 17.58 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.957 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -91.3 140.95 29.3 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.201 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -150.1 150.77 32.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.372 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 29.3 t -91.31 164.38 13.88 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.515 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.8 m -89.41 -7.39 55.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.584 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -117.66 136.9 53.02 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.323 0.582 . . . . 0.0 110.188 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.526 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -90.22 144.13 26.13 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.55 -179.07 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -95.61 148.97 35.44 Favored Pre-proline 0 C--N 1.317 -0.806 0 CA-C-N 114.757 -1.11 . . . . 0.0 111.174 -179.66 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -80.37 -3.81 12.74 Favored 'Trans proline' 0 N--CA 1.494 1.547 0 C-N-CA 122.848 2.365 . . . . 0.0 111.941 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.14 154.02 47.92 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.228 0.537 . . . . 0.0 110.822 -179.346 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.1 tt -70.25 -64.99 0.78 Allowed 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.475 -178.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -55.19 -35.53 64.92 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 120.98 0.419 . . . . 0.0 110.554 -178.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.3 m -55.32 -34.8 64.51 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.016 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.436 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -70.81 -40.3 72.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.782 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -63.03 -41.25 99.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.331 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.411 ' ND1' ' O ' ' A' ' 2' ' ' ASP . 35.6 m170 -63.76 -49.22 73.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.794 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.57 -35.43 79.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.926 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.94 -48.64 79.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.783 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.47 -33.53 74.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.053 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -54.9 -45.24 74.69 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.685 0.279 . . . . 0.0 111.456 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 22.1 pt -73.27 -33.94 42.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.578 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.59 -50.52 43.81 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.705 -178.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.9 p -63.49 -32.26 56.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.188 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.25 -30.24 68.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.715 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.7 m -67.33 -42.06 84.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.762 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 52.1 mt -67.07 -30.47 70.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.756 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 59.8 p . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 118.136 -0.935 . . . . 0.0 110.638 -179.62 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.3 mtt . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' A' ' 3' ' ' HIS . 68.1 t0 -65.47 137.72 57.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.46 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.622 ' ND1' ' NE2' ' A' ' 61' ' ' HIS . 23.9 m170 -82.94 75.09 9.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.569 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.404 ' H ' HG22 ' A' ' 4' ' ' VAL . 18.7 m -96.77 -15.75 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.76 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -56.45 -46.17 80.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.804 -179.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -60.83 -41.98 96.85 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.632 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.85 -33.44 85.79 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -77.74 -49.87 13.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.237 0.541 . . . . 0.0 111.235 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 29.5 tp -62.09 -42.32 99.09 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.169 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -62.85 -41.89 99.54 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.683 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.83 -36.54 80.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.49 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.621 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 83.1 t80 -61.22 -50.61 72.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.816 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.41 -51.53 69.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.904 0.383 . . . . 0.0 110.663 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 51.2 tp -62.85 -44.12 96.99 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.732 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 69.8 tp60 -64.11 -38.49 91.25 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.569 -178.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 68.1 m80 -91.78 -0.46 57.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.718 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 64.7 t30 58.04 66.33 1.13 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.592 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.9 mt -127.93 146.62 50.58 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.017 0.437 . . . . 0.0 110.575 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.512 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 57.0 mp0 -42.62 133.4 3.44 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.103 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.546 HD12 ' N ' ' A' ' 20' ' ' LEU . 10.5 mp -47.2 145.55 3.55 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.691 -178.82 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.42 153.71 55.6 Favored 'Trans proline' 0 N--CA 1.492 1.441 0 C-N-CA 122.497 2.131 . . . . 0.0 111.881 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 67.3 t -128.85 131.87 67.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.324 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -107.34 152.88 23.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.672 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -115.91 144.47 44.0 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.456 178.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -124.95 123.6 40.23 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.288 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 83.9 mt-10 -133.87 130.72 38.24 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -130.14 119.99 23.88 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 120.788 0.328 . . . . 0.0 110.286 -179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -158.87 131.94 7.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.081 0.467 . . . . 0.0 109.898 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.67 141.88 3.49 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 120.432 -0.889 . . . . 0.0 111.223 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_exo -43.88 165.01 0.04 OUTLIER 'Trans proline' 0 C--N 1.314 -1.276 0 C-N-CA 122.222 1.948 . . . . 0.0 112.419 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -53.46 -50.97 12.04 Favored 'Trans proline' 0 N--CA 1.496 1.669 0 C-N-CA 122.48 2.12 . . . . 0.0 112.734 179.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -86.55 3.24 45.1 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.545 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.08 60.95 18.98 Favored Pre-proline 0 C--N 1.331 -0.204 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.893 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -80.8 143.45 14.73 Favored 'Trans proline' 0 C--N 1.311 -1.434 0 C-N-CA 122.642 2.228 . . . . 0.0 111.951 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 87.5 mtm180 -133.18 130.16 38.76 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -114.22 103.78 11.44 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.036 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -102.34 105.36 15.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.12 0.486 . . . . 0.0 109.731 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 69.0 m -114.08 132.93 55.86 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.452 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -111.41 155.52 23.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.293 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.421 ' O ' HG13 ' A' ' 40' ' ' VAL . 2.9 p -121.11 119.9 60.62 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.301 0 CA-C-O 120.923 0.392 . . . . 0.0 109.95 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 74.8 m -97.33 124.88 41.61 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.681 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -146.08 136.83 24.29 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.125 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.441 ' SG ' ' O ' ' A' ' 43' ' ' CYS . 49.6 t 46.76 32.82 1.88 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.808 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 74.11 32.85 57.98 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 111.236 -0.745 . . . . 0.0 111.236 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -136.56 123.62 21.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.804 0.335 . . . . 0.0 110.217 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.2 p -106.13 108.73 20.4 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.115 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -94.5 141.6 28.4 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.007 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -147.86 145.91 28.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.892 0.377 . . . . 0.0 110.422 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.1 p -84.7 163.18 19.36 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.307 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.1 p -90.86 -2.51 57.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.536 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -118.29 154.43 32.3 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.222 0.534 . . . . 0.0 110.105 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.687 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -103.68 134.26 47.31 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.909 -179.405 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.43 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -88.02 147.54 40.99 Favored Pre-proline 0 C--N 1.311 -1.107 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.935 -179.838 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.15 -5.33 16.16 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.759 2.306 . . . . 0.0 112.381 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.429 ' O ' ' OG ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -136.06 155.79 49.69 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.001 0.429 . . . . 0.0 111.107 -179.216 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.97 -64.13 0.92 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.93 -178.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -54.22 -36.17 63.22 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.937 -177.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 55' ' ' THR . 77.8 p -56.05 -33.02 64.58 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.14 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.42 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -71.67 -42.24 67.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.896 0.379 . . . . 0.0 111.128 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -64.21 -42.14 96.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.532 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.622 ' NE2' ' ND1' ' A' ' 3' ' ' HIS . 43.7 m-70 -66.17 -46.8 76.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.718 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.66 -37.98 83.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.762 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.25 -45.47 94.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.687 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.6 -37.07 77.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.364 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.36 -50.03 75.1 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.356 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 96.6 mt -57.82 -47.78 85.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.216 -178.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.6 -43.88 88.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.008 0.432 . . . . 0.0 110.501 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.2 t -59.48 -41.21 83.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.142 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.08 -29.88 70.78 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.652 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 19.7 m -65.17 -41.63 94.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.793 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 56.4 mt -67.59 -29.87 69.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.541 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 43.1 p . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.626 -179.767 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.6 mmm . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -63.17 -42.49 99.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.593 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.51 ' O ' ' CG ' ' A' ' 3' ' ' HIS . 36.2 p-80 -167.26 59.12 0.08 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.589 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.5 m -99.41 -14.93 7.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.452 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -60.31 -44.94 94.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.796 0.332 . . . . 0.0 110.815 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -59.1 -41.66 88.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.533 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.6 -28.01 73.44 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -77.64 -49.61 14.18 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.021 0.438 . . . . 0.0 111.018 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.1 tp -61.63 -42.16 98.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.723 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -62.23 -40.14 95.17 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.833 -179.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.28 -38.07 78.18 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.408 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.618 ' CE1' ' CD2' ' A' ' 16' ' ' HIS . 83.9 t80 -62.05 -51.7 66.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.609 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.492 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.81 -49.21 76.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.514 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 51.5 tp -62.41 -44.79 95.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.636 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -65.35 -39.48 92.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.588 -179.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.618 ' CD2' ' CE1' ' A' ' 12' ' ' TYR . 66.5 m-70 -90.28 -5.71 55.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.6 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.492 ' N ' ' O ' ' A' ' 13' ' ' ALA . 64.5 t30 60.72 67.12 0.85 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.559 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 75.7 mt -126.66 148.12 49.86 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.937 0.398 . . . . 0.0 110.584 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.568 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 55.4 mp0 -42.51 131.92 3.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.269 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 pp -46.08 144.57 2.93 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.635 -179.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -72.53 155.42 54.93 Favored 'Trans proline' 0 C--N 1.308 -1.585 0 C-N-CA 122.769 2.313 . . . . 0.0 112.167 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 59.1 t -130.69 132.02 64.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.458 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -108.88 153.54 23.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.765 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -116.16 144.06 44.67 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.817 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -123.61 122.91 39.37 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.937 -179.13 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -132.39 126.84 34.1 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.735 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -129.99 118.99 22.47 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.844 0.354 . . . . 0.0 110.374 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.53 ' CD ' HH21 ' A' ' 37' ' ' ARG . 11.5 pt-20 -159.55 134.66 8.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.344 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 147.79 144.0 3.92 Favored Glycine 0 CA--C 1.531 1.046 0 N-CA-C 111.144 -0.782 . . . . 0.0 111.144 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -42.49 162.87 0.04 OUTLIER 'Trans proline' 0 C--N 1.309 -1.509 0 C-N-CA 122.666 2.244 . . . . 0.0 112.425 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -53.45 -48.08 23.86 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.523 2.149 . . . . 0.0 112.433 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -89.56 5.16 46.79 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.62 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.7 60.65 16.55 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.66 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -79.65 142.92 16.48 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.597 2.198 . . . . 0.0 111.901 178.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 85.0 mtt85 -131.56 128.94 40.3 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.212 179.147 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -113.65 104.03 11.82 Favored 'General case' 0 C--O 1.217 -0.635 0 C-N-CA 120.479 -0.488 . . . . 0.0 111.335 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.53 HH21 ' CD ' ' A' ' 28' ' ' GLU . 86.9 mtm180 -106.21 104.38 14.07 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 81.2 m -113.08 133.53 54.96 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.309 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -111.34 153.98 25.21 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.313 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.442 ' O ' HG13 ' A' ' 40' ' ' VAL . 3.4 p -121.3 119.7 59.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 121.032 0.444 . . . . 0.0 110.159 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 98.0 m -97.07 123.3 40.78 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.788 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -145.26 136.95 25.39 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.325 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.492 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 43.9 t 46.54 36.05 3.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.528 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 70.56 32.77 67.48 Favored Glycine 0 CA--C 1.52 0.371 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.0 mm100 -136.25 125.54 24.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.722 0.296 . . . . 0.0 110.342 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.0 p -106.83 107.54 18.61 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.965 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.406 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 54.5 m-85 -92.85 140.94 28.98 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.008 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -147.65 151.08 35.58 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.392 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.6 m -88.74 160.68 17.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.463 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 86.8 p -86.37 -7.74 58.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.548 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -127.64 132.16 49.78 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.412 0.625 . . . . 0.0 110.771 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -80.28 148.75 30.61 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.136 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.556 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -98.1 149.69 35.99 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.875 -179.756 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -75.68 -4.39 15.17 Favored 'Trans proline' 0 C--N 1.311 -1.41 0 C-N-CA 122.764 2.309 . . . . 0.0 112.357 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.445 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -130.54 153.23 49.07 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.235 0.541 . . . . 0.0 110.722 -179.343 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.1 tt -69.7 -66.46 0.59 Allowed 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.293 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -53.41 -36.59 61.65 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.515 -178.032 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.445 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 79.1 p -54.73 -32.38 59.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.284 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.27 -40.73 70.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.856 0.36 . . . . 0.0 110.813 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -64.91 -38.67 91.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.477 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 22.9 m170 -64.58 -51.77 61.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.81 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.38 -34.33 77.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.645 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.19 -46.76 85.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.639 -179.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.03 -32.71 70.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.651 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -54.18 -45.34 72.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.825 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.8 pt -74.22 -32.87 33.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.068 0.461 . . . . 0.0 110.804 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.18 -50.27 41.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.239 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.6 p -64.36 -31.18 52.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.626 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.42 -28.78 65.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.524 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.406 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 15.6 m -70.06 -39.82 75.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.063 0.458 . . . . 0.0 110.661 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 51.5 mt -67.37 -29.56 69.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.566 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 82.0 p . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.46 -179.817 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.2 mtm . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 54.99 33.87 21.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.519 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.633 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 6.2 t60 -73.58 60.52 0.67 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.768 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.401 ' H ' HG22 ' A' ' 4' ' ' VAL . 24.1 m -92.67 -15.24 8.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.999 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -59.19 -44.37 92.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.834 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -58.51 -43.09 88.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.258 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.41 -28.27 73.33 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 111.234 -0.746 . . . . 0.0 111.234 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -77.4 -49.58 14.58 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.88 0.372 . . . . 0.0 110.978 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 59.0 tp -63.21 -41.2 99.1 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.323 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -62.49 -41.28 98.69 Favored 'General case' 0 C--N 1.311 -1.101 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.623 -179.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.09 -37.85 81.68 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.934 179.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 80.5 t80 -61.67 -51.22 69.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.775 -179.333 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.32 -48.5 80.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.434 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.3 tp -62.73 -44.24 96.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.469 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.9 tp60 -65.24 -40.19 93.71 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.601 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 69.1 m80 -89.55 -1.69 58.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.692 -179.597 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 60.9 t-20 58.59 65.95 1.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.546 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.8 mt -127.4 151.15 49.17 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.583 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -45.58 129.52 8.75 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.722 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.487 HD23 ' H ' ' A' ' 20' ' ' LEU . 0.2 OUTLIER -46.35 146.27 2.4 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.598 -178.876 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.26 152.88 66.97 Favored 'Trans proline' 0 N--CA 1.494 1.501 0 C-N-CA 122.396 2.064 . . . . 0.0 112.041 179.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.1 t -129.83 129.39 66.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.535 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -104.73 152.61 22.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.331 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.458 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -117.93 145.24 44.82 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.526 178.32 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -121.5 125.62 47.26 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.665 0.269 . . . . 0.0 111.245 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -134.69 123.64 24.02 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 -125.02 113.47 17.82 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -148.95 128.48 13.12 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.78 139.35 3.06 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 120.488 -0.863 . . . . 0.0 111.331 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -44.1 166.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 121.875 1.717 . . . . 0.0 112.743 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -54.93 -47.7 25.21 Favored 'Trans proline' 0 N--CA 1.502 1.974 0 C-N-CA 122.357 2.038 . . . . 0.0 112.455 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -86.47 -0.55 56.28 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.526 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.84 60.57 19.17 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.709 178.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -81.93 144.49 13.62 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 122.6 2.2 . . . . 0.0 111.731 178.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.401 ' NH2' ' CD1' ' A' ' 52' ' ' PHE . 82.8 mtp180 -131.86 131.0 42.41 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 178.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -114.96 103.83 11.31 Favored 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 120.161 -0.616 . . . . 0.0 111.296 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.7 mtm180 -101.77 106.36 17.35 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.077 0.465 . . . . 0.0 110.226 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.458 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 42.1 t -109.79 124.5 51.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.375 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -106.63 150.55 26.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.711 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.433 ' O ' HG13 ' A' ' 40' ' ' VAL . 3.4 p -119.28 119.46 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.11 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 94.8 m -94.66 120.19 34.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.212 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.486 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 4.5 t80 -141.36 138.01 32.74 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.203 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.486 ' SG ' ' O ' ' A' ' 42' ' ' PHE . 13.8 p 41.9 44.13 2.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.945 0.402 . . . . 0.0 110.718 179.625 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 64.64 32.63 84.84 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.443 ' N ' ' O ' ' A' ' 42' ' ' PHE . 47.6 tp60 -137.73 122.51 18.76 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.912 0.387 . . . . 0.0 110.384 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 32.7 p -103.69 109.08 20.64 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.129 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.499 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 15.9 m-85 -89.9 140.74 29.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.859 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -144.95 154.01 42.13 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.341 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.1 m -98.62 159.85 14.67 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.415 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 93.7 p -89.88 -6.88 55.35 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.56 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -116.26 148.88 40.03 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.146 0.498 . . . . 0.0 110.189 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.689 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -101.59 131.26 47.88 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-N 115.228 -0.897 . . . . 0.0 109.822 -179.331 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.462 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -85.98 148.84 49.06 Favored Pre-proline 0 C--N 1.307 -1.247 0 CA-C-N 114.142 -1.39 . . . . 0.0 110.688 -179.566 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -77.42 -5.17 15.39 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 122.395 2.064 . . . . 0.0 112.563 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.4 HG22 ' N ' ' A' ' 56' ' ' LEU . 48.7 m -135.43 153.09 51.9 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.255 0.55 . . . . 0.0 111.179 -179.38 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.4 ' N ' HG22 ' A' ' 55' ' ' THR . 0.5 OUTLIER -64.7 -62.56 1.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.554 -178.782 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.47 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 69.0 mttm -55.07 -33.63 62.91 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 120.992 0.425 . . . . 0.0 110.601 -177.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.4 t -56.46 -36.93 69.62 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.003 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.87 -41.62 74.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.7 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -61.13 -40.81 95.2 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.42 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.633 ' ND1' ' CE1' ' A' ' 3' ' ' HIS . 0.4 OUTLIER -67.5 -44.87 77.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.656 -179.525 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.92 -40.85 87.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.074 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.77 -50.68 72.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.682 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.459 ' O ' HG12 ' A' ' 68' ' ' VAL . . . -61.33 -37.73 84.34 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.351 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -55.81 -45.89 78.17 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.881 0.372 . . . . 0.0 110.324 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.62 -43.82 93.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.862 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.24 -49.56 64.01 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -178.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 64' ' ' ALA . 8.4 p -65.05 -31.77 55.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.175 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.95 -27.56 65.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.633 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 59.7 p -71.53 -39.18 70.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.599 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 49.9 mt -67.51 -31.25 71.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.75 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 62.7 m . . . . . 0 C--O 1.221 -0.418 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.562 179.986 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.5 mtt . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -69.21 146.68 52.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.339 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.632 ' ND1' ' CD2' ' A' ' 61' ' ' HIS . 79.5 m-70 -123.07 31.85 5.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.604 -179.615 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 32.7 m -84.47 -20.16 8.76 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.094 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -55.77 -43.74 77.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.828 0.346 . . . . 0.0 110.923 -178.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -59.88 -42.59 94.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.437 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -74.55 -26.32 67.95 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.66 -0.576 . . . . 0.0 111.66 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -77.17 -49.02 16.1 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.655 0.264 . . . . 0.0 111.506 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.6 tp -63.58 -41.37 98.38 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.179 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -65.12 -42.13 94.22 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.257 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.14 -37.57 84.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.667 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 92.4 t80 -61.5 -48.93 78.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.657 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.441 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.82 -45.83 82.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.798 0.332 . . . . 0.0 110.521 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.3 tp -62.86 -46.17 89.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.729 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -66.04 -42.68 89.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.966 0.413 . . . . 0.0 110.627 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.481 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 66.9 t-80 -84.8 -5.43 59.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.831 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.441 ' N ' ' O ' ' A' ' 13' ' ' ALA . 61.7 t-20 58.66 65.46 1.24 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.716 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.407 HD21 ' ND1' ' A' ' 16' ' ' HIS . 80.5 mt -123.38 148.37 46.14 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.683 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -41.72 152.64 0.07 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.302 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.445 ' CD2' ' N ' ' A' ' 20' ' ' LEU . 3.6 mm? -61.61 139.43 95.18 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.468 -178.577 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -72.07 152.89 57.32 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 122.362 2.042 . . . . 0.0 112.013 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 72.2 t -131.45 130.96 63.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.935 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -107.28 152.22 24.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.422 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.442 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -115.94 141.53 47.99 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 115.602 -0.727 . . . . 0.0 109.133 178.12 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -119.8 125.14 47.84 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.751 0.31 . . . . 0.0 111.353 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -134.01 128.69 34.87 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -131.11 119.72 22.35 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -158.4 132.55 7.95 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 147.43 147.57 4.57 Favored Glycine 0 CA--C 1.538 1.469 0 C-N-CA 120.596 -0.811 . . . . 0.0 111.92 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -44.71 160.27 0.11 Allowed 'Trans proline' 0 N--CA 1.501 1.966 0 C-N-CA 122.194 1.929 . . . . 0.0 112.035 178.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -57.18 -44.7 41.22 Favored 'Trans proline' 0 N--CA 1.504 2.095 0 C-N-CA 122.704 2.269 . . . . 0.0 112.285 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -86.1 -2.13 58.04 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.071 0.462 . . . . 0.0 110.293 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.93 61.28 17.69 Favored Pre-proline 0 N--CA 1.462 0.168 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.496 178.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -81.29 145.95 15.39 Favored 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.706 2.271 . . . . 0.0 111.458 179.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -129.4 128.46 43.06 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -114.54 103.07 10.65 Favored 'General case' 0 CA--C 1.498 -1.029 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.963 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.9 mmm-85 -101.31 107.41 18.76 Favored 'General case' 0 C--N 1.316 -0.856 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.386 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 43.7 t -111.85 126.21 54.85 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.787 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -106.36 152.98 22.87 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 p -121.14 120.4 62.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.279 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 52.1 m -98.22 120.44 38.64 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.913 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.497 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 6.3 t80 -144.06 137.35 27.53 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.264 -0.425 . . . . 0.0 109.988 -179.689 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.497 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 7.6 m 47.46 40.04 10.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.832 0.349 . . . . 0.0 110.754 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 66.02 31.72 80.31 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 111.598 -0.601 . . . . 0.0 111.598 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -135.83 126.01 26.31 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.746 0.307 . . . . 0.0 110.355 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 27.6 m -107.51 108.83 20.32 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.877 0.37 . . . . 0.0 110.852 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -93.31 141.92 27.9 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.744 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -142.94 144.23 32.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.593 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.5 p -84.11 162.19 20.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.634 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.7 p -93.3 -7.53 44.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.225 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -116.96 152.58 34.27 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.364 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.699 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -103.73 132.48 49.94 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.85 0.833 . . . . 0.0 109.735 -179.671 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.406 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -87.48 149.42 46.58 Favored Pre-proline 0 C--N 1.303 -1.423 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.454 -179.855 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.12 -5.1 14.91 Favored 'Trans proline' 0 N--CA 1.494 1.515 0 C-N-CA 122.588 2.192 . . . . 0.0 112.704 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 51.6 m -135.09 150.95 50.32 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.875 0.369 . . . . 0.0 111.201 -178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.31 -61.73 2.16 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.734 -178.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.523 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 68.8 mttm -54.95 -34.44 63.27 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 120.792 0.33 . . . . 0.0 110.91 -178.166 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.2 t -55.57 -38.42 69.33 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.066 0.46 . . . . 0.0 109.849 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.59 -41.68 79.28 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.345 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -64.12 -43.67 94.58 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.764 0.316 . . . . 0.0 110.821 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.632 ' CD2' ' ND1' ' A' ' 3' ' ' HIS . 84.8 m-70 -67.38 -45.61 75.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.674 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.0 -40.37 87.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.2 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.01 -45.37 93.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.839 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.41 ' O ' HG23 ' A' ' 68' ' ' VAL . . . -58.95 -38.19 78.48 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.527 -179.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -57.83 -48.45 79.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.789 179.132 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.6 mt -57.87 -48.88 82.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.166 -178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.03 -43.47 92.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.639 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 64' ' ' ALA . 20.8 t -59.14 -42.58 87.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 109.994 -179.595 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.99 -29.86 71.15 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.929 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.8 t -65.43 -43.36 90.71 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 120.876 0.369 . . . . 0.0 111.285 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 53.4 mt -65.94 -31.17 71.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.591 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 75.6 p . . . . . 0 C--O 1.219 -0.521 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.503 179.878 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.0 mtp . . . . . 0 N--CA 1.489 1.493 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.48 ' OD1' ' N ' ' A' ' 2' ' ' ASP . 25.2 p-10 -92.36 -0.91 57.34 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.687 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.518 ' O ' ' CG ' ' A' ' 3' ' ' HIS . 1.3 t60 -145.35 30.89 1.11 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.065 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.403 ' H ' HG22 ' A' ' 4' ' ' VAL . 21.9 m -92.96 -16.97 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.776 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -61.43 -42.79 99.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.8 0.334 . . . . 0.0 111.063 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.485 ' CD ' ' HE1' ' A' ' 3' ' ' HIS . 88.7 tttt -59.33 -39.6 83.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.412 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.28 -24.34 59.36 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -77.28 -50.1 13.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.149 0.5 . . . . 0.0 110.859 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.5 tp -63.27 -41.79 99.06 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.328 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.0 tp-100 -60.79 -41.3 95.3 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 120.086 -0.645 . . . . 0.0 110.803 -178.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.67 -37.3 86.12 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.426 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 81.0 t80 -61.35 -49.87 75.21 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.898 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.488 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.96 -49.39 75.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.953 0.406 . . . . 0.0 110.293 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.2 tp -62.78 -44.25 96.66 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.581 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -64.17 -37.32 87.05 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.698 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 59.3 m80 -94.83 -2.36 50.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.7 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 13' ' ' ALA . 55.2 t-20 59.29 66.57 1.01 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.715 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 71.5 mt -124.49 149.96 46.29 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.459 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -46.06 134.58 8.16 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.906 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.49 HD23 ' H ' ' A' ' 20' ' ' LEU . 0.2 OUTLIER -46.91 146.73 2.57 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.745 -178.844 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.36 154.66 45.93 Favored 'Trans proline' 0 N--CA 1.496 1.631 0 C-N-CA 122.758 2.306 . . . . 0.0 112.354 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.0 t -129.9 130.38 66.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.379 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -107.42 152.34 24.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.857 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.438 ' HB3' ' CG ' ' A' ' 39' ' ' ASN . . . -119.68 134.87 55.06 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -115.59 125.68 53.25 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.983 0.42 . . . . 0.0 111.516 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -129.83 127.75 40.91 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.515 178.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 -129.47 117.82 21.13 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 120.657 0.265 . . . . 0.0 110.314 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -157.17 130.75 8.03 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 150.65 139.77 3.08 Favored Glycine 0 CA--C 1.533 1.178 0 C-N-CA 120.506 -0.854 . . . . 0.0 111.204 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_exo -43.79 162.93 0.05 OUTLIER 'Trans proline' 0 C--N 1.314 -1.287 0 C-N-CA 122.243 1.962 . . . . 0.0 112.542 179.486 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -52.08 -48.95 19.04 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.414 2.076 . . . . 0.0 112.543 179.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -86.77 0.48 54.68 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.593 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.12 61.55 21.59 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.025 179.02 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -82.68 144.47 12.48 Favored 'Trans proline' 0 C--N 1.308 -1.574 0 C-N-CA 122.748 2.298 . . . . 0.0 111.893 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 87.5 mtm180 -133.57 130.4 38.36 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -113.78 104.13 11.9 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.461 -0.496 . . . . 0.0 111.144 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.432 ' NH2' ' OE1' ' A' ' 48' ' ' GLN . 81.1 mtp85 -106.34 105.46 15.5 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.1 m -119.15 144.0 46.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.067 0.461 . . . . 0.0 110.203 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.438 ' CG ' ' HB3' ' A' ' 24' ' ' ALA . 13.6 p30 -124.3 160.1 28.78 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.452 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.427 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.1 p -120.28 120.69 63.63 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.253 0 CA-C-O 121.119 0.485 . . . . 0.0 110.202 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.407 ' OG1' HG22 ' A' ' 46' ' ' THR . 66.7 m -95.9 116.96 29.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.152 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -139.34 137.36 35.71 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.97 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.497 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 43.1 t 48.04 32.3 2.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.814 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.86 33.52 57.5 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -137.87 122.86 19.03 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.407 HG22 ' OG1' ' A' ' 41' ' ' THR . 18.7 p -105.02 109.56 21.61 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.05 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -95.12 141.42 28.77 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.084 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.432 ' OE1' ' NH2' ' A' ' 37' ' ' ARG . 7.0 tt0 -148.31 144.51 27.63 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.856 0.36 . . . . 0.0 110.546 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.3 p -84.3 163.13 19.81 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.631 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.0 m -89.76 -7.34 54.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.648 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -112.28 148.94 33.11 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.128 0.49 . . . . 0.0 109.929 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.685 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -101.61 131.95 47.54 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.481 -179.615 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.503 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -86.43 148.29 46.45 Favored Pre-proline 0 C--N 1.307 -1.257 0 CA-C-N 114.076 -1.42 . . . . 0.0 111.131 -179.489 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -77.42 -8.38 17.25 Favored 'Trans proline' 0 N--CA 1.495 1.584 0 C-N-CA 122.674 2.25 . . . . 0.0 111.984 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 41.5 m -129.07 148.4 51.02 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.772 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 56' ' ' LEU . 1.4 tt -63.83 -61.9 1.99 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.159 -178.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.529 ' HB3' ' CE1' ' A' ' 61' ' ' HIS . 63.5 mttp -54.49 -34.21 61.21 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 121.028 -0.269 . . . . 0.0 110.741 -178.287 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.5 t -55.89 -34.03 65.17 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.104 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.87 -41.98 67.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.158 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -63.99 -41.68 97.43 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.663 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.529 ' CE1' ' HB3' ' A' ' 57' ' ' LYS . 23.3 m170 -66.99 -47.76 70.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.811 0.339 . . . . 0.0 110.83 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.51 -38.29 84.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.606 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.8 -48.37 82.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.597 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.06 -36.81 80.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.366 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.0 -47.43 83.05 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 97.1 mt -59.69 -45.92 93.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.106 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.32 -43.29 86.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.087 0.47 . . . . 0.0 110.41 179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.1 t -59.56 -42.3 87.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.216 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.05 -27.45 69.11 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.969 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.4 t -67.08 -42.08 85.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.557 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 52.5 mt -66.19 -30.25 70.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.643 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.221 -0.432 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.719 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.3 mtt . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 42.2 -111.1 0.15 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.557 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -147.46 110.02 4.64 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.287 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.4 m -98.24 -15.52 7.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 CA-C-O 120.58 0.229 . . . . 0.0 110.936 179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.639 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 4.7 m-85 -58.14 -42.97 87.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.862 -178.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.412 ' NZ ' ' OE1' ' A' ' 60' ' ' GLU . 98.8 mttt -59.45 -40.37 86.62 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.213 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -69.99 -28.15 72.13 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.202 -0.759 . . . . 0.0 111.202 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -77.28 -50.68 12.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.103 0.478 . . . . 0.0 111.357 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 56.1 tp -62.38 -41.51 98.7 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.259 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -62.53 -39.62 94.16 Favored 'General case' 0 C--N 1.31 -1.134 0 C-N-CA 119.641 -0.824 . . . . 0.0 110.035 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.42 -39.39 77.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.82 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -61.78 -52.61 63.52 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.031 -179.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.87 -47.86 79.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.021 0.439 . . . . 0.0 110.304 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.8 tp -62.56 -44.41 96.39 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.593 -179.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -65.03 -40.89 95.49 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.597 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.525 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 64.8 t-80 -87.03 -2.8 58.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.77 -179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 58.5 t30 58.72 65.56 1.22 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.888 0.375 . . . . 0.0 110.185 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.8 mt -128.67 147.43 50.74 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.498 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -41.7 133.41 2.73 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.568 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.5 mt -48.13 144.39 5.99 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.96 -179.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -70.6 153.94 64.74 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.317 2.012 . . . . 0.0 111.952 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.5 t -131.43 130.54 62.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.636 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -105.22 153.11 22.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.447 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.475 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -119.57 140.81 49.96 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.371 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -118.05 126.69 52.77 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.787 0.327 . . . . 0.0 111.205 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -136.5 131.16 33.59 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 178.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.9 ttp85 -130.24 119.49 22.98 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -157.83 132.07 8.22 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 150.57 140.64 3.23 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 120.23 -0.986 . . . . 0.0 111.225 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -42.92 166.64 0.03 OUTLIER 'Trans proline' 0 N--CA 1.488 1.156 0 C-N-CA 122.079 1.853 . . . . 0.0 112.853 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -55.28 -50.43 13.0 Favored 'Trans proline' 0 N--CA 1.502 2.015 0 C-N-CA 122.522 2.148 . . . . 0.0 112.941 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -87.13 3.15 47.48 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.489 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.16 60.24 16.97 Favored Pre-proline 0 CA--C 1.531 0.212 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.044 178.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -80.12 144.26 16.55 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.608 2.205 . . . . 0.0 111.73 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.609 ' NH1' ' CD1' ' A' ' 52' ' ' PHE . 96.5 mtt-85 -133.36 131.39 40.02 Favored 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -114.36 103.96 11.59 Favored 'General case' 0 CA--C 1.508 -0.639 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.85 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -99.97 106.61 18.43 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.646 -0.422 . . . . 0.0 109.909 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.475 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 45.9 t -111.02 123.05 49.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.505 -179.479 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -106.47 150.55 25.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.002 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.483 ' O ' HG13 ' A' ' 40' ' ' VAL . 5.5 p -119.76 119.74 61.23 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.201 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 96.5 m -93.96 122.12 36.14 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.375 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -143.0 131.99 22.94 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.473 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 49.9 t 46.14 46.7 13.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.933 0.397 . . . . 0.0 110.81 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.09 33.2 84.97 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.281 -0.727 . . . . 0.0 111.281 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.423 ' CG ' ' CE1' ' A' ' 47' ' ' PHE . 68.1 tp60 -139.28 125.17 19.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.826 0.346 . . . . 0.0 110.203 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.8 p -105.41 109.95 22.11 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.233 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.423 ' CE1' ' CG ' ' A' ' 45' ' ' GLN . 51.4 m-85 -90.77 140.88 29.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.165 -0.47 . . . . 0.0 109.782 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -148.51 149.4 31.58 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.175 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 42.5 t -88.69 162.12 16.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.642 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 96.4 p -87.67 -6.8 58.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.716 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -123.1 143.45 49.97 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.211 0.529 . . . . 0.0 110.781 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.609 ' CD1' ' NH1' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -91.7 142.62 27.41 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.891 -179.272 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.501 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -94.22 147.59 33.63 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 114.659 -1.155 . . . . 0.0 111.185 -179.568 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -76.15 -4.71 15.45 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 C-N-CA 122.69 2.26 . . . . 0.0 112.496 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.33 155.37 50.71 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.225 0.536 . . . . 0.0 111.132 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.03 -64.04 0.94 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.371 -178.562 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -54.64 -34.23 61.82 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 120.659 0.266 . . . . 0.0 110.575 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.6 t -55.79 -36.44 67.39 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.573 -0.451 . . . . 0.0 109.803 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.482 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -70.84 -41.19 71.79 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.5 -179.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.412 ' OE1' ' NZ ' ' A' ' 6' ' ' LYS . 98.7 mt-10 -62.15 -43.06 99.68 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.874 -179.395 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.639 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -62.7 -51.38 67.41 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.208 0.528 . . . . 0.0 110.311 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.57 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -64.84 -35.24 80.47 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.176 -178.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.79 -49.39 77.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.594 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.7 -32.52 71.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.612 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -55.22 -45.75 75.96 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.619 0.247 . . . . 0.0 111.151 -179.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.3 pt -72.12 -37.45 59.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.62 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.85 -50.44 56.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.001 0.429 . . . . 0.0 111.961 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.96 -36.81 78.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.67 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.61 -26.96 68.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.755 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 37.5 m -78.49 -25.29 45.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.936 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.8 mt -119.43 29.01 7.85 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.28 0.562 . . . . 0.0 110.092 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 42.2 m . . . . . 0 C--N 1.322 -0.613 0 CA-C-O 117.904 -1.046 . . . . 0.0 110.534 179.309 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.6 mtm . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -69.04 140.75 54.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.443 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.609 ' CB ' ' CE1' ' A' ' 61' ' ' HIS . 53.5 p-80 -77.71 69.99 4.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.918 -179.699 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.1 m -105.38 -13.93 9.09 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.121 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.924 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -60.13 -42.17 94.22 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.826 0.346 . . . . 0.0 110.867 -178.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -60.87 -41.25 95.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.211 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.37 -31.62 81.47 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.736 -0.946 . . . . 0.0 110.736 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -75.94 -48.53 20.84 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.709 0.29 . . . . 0.0 111.459 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.431 HD23 ' OH ' ' A' ' 23' ' ' TYR . 48.2 tp -62.99 -39.42 94.66 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.305 -179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -63.06 -41.66 99.5 Favored 'General case' 0 N--CA 1.437 -1.105 0 C-N-CA 119.655 -0.818 . . . . 0.0 110.285 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.64 -40.25 84.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.895 179.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.42 ' O ' ' N ' ' A' ' 16' ' ' HIS . 53.8 t80 -61.98 -51.28 68.69 Favored 'General case' 0 N--CA 1.462 0.148 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.805 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.98 -40.4 73.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.433 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 39.1 tp -63.17 -46.21 88.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.529 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -79.61 -20.52 46.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.975 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.42 ' N ' ' O ' ' A' ' 12' ' ' TYR . 38.8 t-80 -87.15 -13.55 43.74 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.693 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 49.62 64.88 1.58 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.249 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.551 HD21 ' CZ ' ' A' ' 42' ' ' PHE . 0.9 OUTLIER -139.79 169.16 18.22 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.982 0.42 . . . . 0.0 110.452 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -46.36 126.08 7.54 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.739 178.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.539 HD23 ' H ' ' A' ' 20' ' ' LEU . 0.2 OUTLIER -45.81 151.42 0.85 Allowed Pre-proline 0 CA--C 1.539 0.542 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.669 -178.95 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.18 151.03 72.39 Favored 'Trans proline' 0 N--CA 1.499 1.802 0 C-N-CA 122.42 2.08 . . . . 0.0 112.215 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.4 t -133.51 131.08 57.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.227 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.431 ' OH ' HD23 ' A' ' 9' ' ' LEU . 32.2 m-85 -106.14 152.13 23.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.885 179.319 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.43 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -114.56 146.01 41.27 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.1 178.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -124.42 124.56 42.6 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.788 0.328 . . . . 0.0 111.636 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -132.75 129.07 38.16 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 71.2 ttt-85 -134.3 120.36 19.84 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.355 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -162.18 135.1 5.96 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.496 -0.481 . . . . 0.0 109.843 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 145.02 163.42 10.08 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 120.316 -0.945 . . . . 0.0 112.185 178.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -54.03 159.82 6.96 Favored 'Trans proline' 0 N--CA 1.504 2.116 0 C-N-CA 122.571 2.181 . . . . 0.0 111.894 177.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -60.4 -42.39 41.68 Favored 'Trans proline' 0 N--CA 1.505 2.202 0 C-N-CA 122.863 2.375 . . . . 0.0 113.002 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -87.86 -2.05 58.36 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.206 0.527 . . . . 0.0 110.168 -179.648 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.79 62.28 17.17 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.583 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -78.42 142.62 18.81 Favored 'Trans proline' 0 C--N 1.304 -1.771 0 C-N-CA 122.622 2.215 . . . . 0.0 111.626 179.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -118.99 121.4 39.83 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -114.56 102.39 10.01 Favored 'General case' 0 CA--C 1.505 -0.787 0 C-N-CA 119.647 -0.821 . . . . 0.0 111.53 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.5 mtp85 -101.08 107.82 19.35 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.789 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.43 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 48.4 t -109.53 122.35 47.24 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.634 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.508 ' OD1' ' N ' ' A' ' 40' ' ' VAL . 40.8 t-20 -103.61 150.74 23.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.701 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.508 ' N ' ' OD1' ' A' ' 39' ' ' ASN . 4.0 p -122.42 119.6 58.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.866 0.365 . . . . 0.0 110.417 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 98.3 m -96.47 121.33 38.16 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.072 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.551 ' CZ ' HD21 ' A' ' 18' ' ' LEU . 6.1 t80 -144.19 136.0 26.09 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.422 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 42.7 t 45.82 44.65 11.07 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.411 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.54 30.76 77.48 Favored Glycine 0 CA--C 1.526 0.776 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.921 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -135.48 131.06 35.64 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 122.691 -0.299 . . . . 0.0 110.314 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 54.4 p -108.8 107.4 17.81 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.047 0.451 . . . . 0.0 111.101 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -92.7 141.56 28.34 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.111 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -152.23 147.7 26.7 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.749 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.4 p -85.79 166.14 16.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.818 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 85.3 p -92.64 -6.96 48.28 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.626 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -122.7 129.51 51.89 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.006 0.432 . . . . 0.0 110.898 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -79.2 148.64 32.19 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.686 0.755 . . . . 0.0 110.17 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.485 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -96.22 150.33 37.05 Favored Pre-proline 0 C--N 1.313 -0.982 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.857 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -77.6 -4.41 14.57 Favored 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 122.421 2.081 . . . . 0.0 112.712 178.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.8 152.42 51.74 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 120.961 0.41 . . . . 0.0 110.851 -179.516 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.43 -62.44 1.53 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.762 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -56.11 -35.97 67.68 Favored 'General case' 0 CA--C 1.52 -0.198 0 O-C-N 122.137 -0.352 . . . . 0.0 110.816 -177.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 38.5 m -54.68 -36.12 64.3 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.451 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -69.1 -43.21 74.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.454 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.54 -41.86 97.97 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.463 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.609 ' CE1' ' CB ' ' A' ' 3' ' ' HIS . 32.0 m-70 -62.73 -48.81 77.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.766 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.05 -35.51 80.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.827 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.47 -48.88 79.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.478 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.86 -33.49 75.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -54.79 -46.91 74.51 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.656 0.265 . . . . 0.0 111.084 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.1 pt -73.97 -33.11 35.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.872 0.368 . . . . 0.0 110.663 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.435 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -67.33 -50.26 60.76 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.831 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.3 p -65.4 -30.11 49.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.527 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.41 -33.86 73.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.118 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.435 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 78.0 p -67.07 -39.67 86.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.019 0.438 . . . . 0.0 110.576 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 56.6 mt -66.79 -31.83 72.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.621 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 84.8 m . . . . . 0 C--O 1.219 -0.513 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.495 179.945 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.459 ' O ' ' N ' ' A' ' 3' ' ' HIS . 97.3 mmm . . . . . 0 N--CA 1.489 1.477 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 41.76 -94.3 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.9 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.551 ' O ' ' CG ' ' A' ' 3' ' ' HIS . 12.2 t-80 52.49 50.25 18.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.937 179.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -117.96 -44.64 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-O 120.966 0.412 . . . . 0.0 110.635 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.628 ' N ' ' CD1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -61.17 -23.83 65.85 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.859 -179.551 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -62.39 -42.39 99.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.154 0.502 . . . . 0.0 110.322 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.72 -23.55 76.44 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.086 -0.806 . . . . 0.0 111.086 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -78.04 -50.35 12.25 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.83 0.348 . . . . 0.0 111.179 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.5 tp -62.74 -42.59 99.74 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.14 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.9 tp-100 -64.45 -42.58 95.88 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.138 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.91 -37.27 78.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.824 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -61.52 -49.83 75.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.679 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.473 ' HB2' ' HZ ' ' A' ' 42' ' ' PHE . . . -58.6 -47.3 84.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.934 0.397 . . . . 0.0 110.246 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.4 tp -62.15 -46.37 89.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.517 -179.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -65.76 -38.7 89.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.976 0.417 . . . . 0.0 110.487 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.502 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 61.6 t-80 -87.51 -0.58 57.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.607 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 56.5 65.1 1.5 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.642 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 81.6 mt -127.71 151.7 48.65 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.678 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -46.86 128.0 10.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.131 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.573 ' N ' HD12 ' A' ' 20' ' ' LEU . 10.0 mp -46.95 147.95 2.08 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.473 -178.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.06 152.57 62.7 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.369 2.046 . . . . 0.0 112.214 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 68.7 t -130.22 130.2 65.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.517 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -105.37 152.62 22.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.596 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.494 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -116.56 145.1 43.6 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.476 178.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -123.29 124.62 43.39 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.837 0.351 . . . . 0.0 111.234 -179.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -134.14 134.75 42.55 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.805 178.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -135.35 121.34 19.92 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.687 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -153.95 125.77 7.71 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 145.74 154.5 6.18 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.667 ' HG2' ' HB3' ' A' ' 33' ' ' ALA . 55.5 Cg_endo -68.13 166.38 25.19 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.109 1.873 . . . . 0.0 111.846 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.87 -43.78 53.62 Favored 'Trans proline' 0 N--CA 1.503 2.047 0 C-N-CA 122.395 2.063 . . . . 0.0 113.059 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -78.97 -13.28 59.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.639 0.257 . . . . 0.0 111.129 -178.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.667 ' HB3' ' HG2' ' A' ' 30' ' ' PRO . . . -140.0 64.37 27.14 Favored Pre-proline 0 N--CA 1.467 0.409 0 CA-C-O 121.173 0.511 . . . . 0.0 110.807 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -82.07 141.5 11.79 Favored 'Trans proline' 0 C--N 1.312 -1.38 0 C-N-CA 122.462 2.108 . . . . 0.0 110.897 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -127.26 125.74 41.47 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -114.86 104.35 11.85 Favored 'General case' 0 CA--C 1.506 -0.737 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.789 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -101.76 107.25 18.4 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.065 0.46 . . . . 0.0 110.599 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.494 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 50.9 t -109.55 124.25 50.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.967 -179.491 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -105.24 149.95 25.55 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.476 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.3 p -119.7 119.32 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 120.913 0.387 . . . . 0.0 110.025 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 96.4 m -95.67 121.93 37.9 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.12 179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.482 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 5.3 t80 -143.07 137.38 29.15 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.36 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.483 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 12.0 p 42.19 42.83 2.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.829 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 66.16 32.35 82.01 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.436 -0.666 . . . . 0.0 111.436 179.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.419 ' N ' ' O ' ' A' ' 42' ' ' PHE . 29.0 mm100 -136.46 130.87 33.25 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.66 0.266 . . . . 0.0 110.357 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 61.8 p -110.04 107.59 17.51 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.221 -179.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.427 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 52.3 m-85 -94.14 141.06 28.97 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.966 179.588 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -154.26 148.03 25.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.481 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.6 p -85.31 168.21 14.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.464 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.9 p -93.83 -0.61 55.71 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.544 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -120.88 153.28 37.38 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.044 0.449 . . . . 0.0 110.344 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.686 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -103.94 134.69 46.81 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.813 -179.488 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.49 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -86.27 147.99 46.17 Favored Pre-proline 0 C--N 1.306 -1.318 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.579 -179.695 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.41 -4.63 15.28 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.704 2.269 . . . . 0.0 112.433 179.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -136.09 154.73 50.92 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.079 0.466 . . . . 0.0 111.22 -179.37 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.17 -62.62 1.43 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.312 -178.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.41 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 98.8 mttt -55.39 -34.46 64.37 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.756 0.312 . . . . 0.0 110.658 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 39.4 m -54.48 -35.94 63.61 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.454 -0.498 . . . . 0.0 109.925 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.477 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -72.17 -43.71 64.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.408 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -63.76 -44.27 93.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.645 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.41 ' CD2' ' O ' ' A' ' 57' ' ' LYS . 89.3 m-70 -64.04 -49.19 73.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.627 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.93 -35.2 79.96 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.611 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.15 -41.43 83.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.261 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.28 -34.59 78.34 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.625 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -53.87 -47.58 70.91 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.508 0.194 . . . . 0.0 110.907 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.403 HG12 ' H ' ' A' ' 66' ' ' ILE . 25.8 pt -74.35 -27.93 22.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.583 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.58 -51.15 30.3 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.914 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.0 p -63.27 -30.67 50.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.425 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.9 -35.1 76.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.862 0.363 . . . . 0.0 110.794 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.427 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 17.7 m -62.03 -42.94 99.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.668 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.1 mt -66.69 -30.21 70.4 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.627 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 74.1 m . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.601 179.991 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.6 mtp . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -68.98 142.81 54.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.329 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.4 ' HE2' ' HD3' ' A' ' 57' ' ' LYS . 80.6 m-70 -94.91 80.71 3.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.328 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 33.2 m -82.1 -16.18 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.859 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.66 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 3.2 m-85 -59.31 -44.21 92.58 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.759 -178.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -58.45 -43.53 88.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.413 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -72.79 -24.38 76.18 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 69.7 tp60 -77.13 -48.77 16.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.946 0.403 . . . . 0.0 111.087 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.4 HD23 ' OH ' ' A' ' 23' ' ' TYR . 58.8 tp -61.75 -41.45 97.7 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.291 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -62.85 -40.82 98.64 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.743 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.98 -38.18 79.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.553 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 86.0 t80 -62.0 -51.75 66.78 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.665 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.511 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -58.19 -46.22 86.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.416 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.6 tp -62.26 -47.2 85.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.729 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -66.19 -36.44 83.1 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.627 -179.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 61.8 m80 -92.05 -3.2 56.09 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.711 -179.671 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.511 ' N ' ' O ' ' A' ' 13' ' ' ALA . 97.4 m-20 56.76 66.01 1.27 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.698 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 70.1 mt -125.31 145.39 50.04 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.988 0.423 . . . . 0.0 110.48 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.644 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 1.3 pm0 -41.04 134.96 1.89 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.183 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.8 mt -47.31 143.37 5.17 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.973 -179.006 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -73.06 153.41 52.07 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 122.37 2.047 . . . . 0.0 111.989 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.4 t -129.65 130.62 66.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.413 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.4 ' OH ' HD23 ' A' ' 9' ' ' LEU . 33.6 m-85 -107.02 153.01 23.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.718 179.56 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.504 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -115.47 146.39 41.7 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.326 178.647 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -123.97 124.16 41.98 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.062 0.458 . . . . 0.0 111.357 -179.342 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -134.86 129.34 34.27 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.344 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.0 ttt-85 -133.32 123.6 25.73 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.532 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.537 ' OE2' ' NH2' ' A' ' 37' ' ' ARG . 14.4 pt-20 -157.71 128.21 6.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.936 0.398 . . . . 0.0 109.996 179.344 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 143.34 161.37 8.82 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 111.234 -0.746 . . . . 0.0 111.234 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.706 ' HG2' ' HB3' ' A' ' 33' ' ' ALA . 42.5 Cg_endo -68.83 163.2 38.27 Favored 'Trans proline' 0 C--N 1.306 -1.675 0 C-N-CA 122.405 2.07 . . . . 0.0 111.354 178.623 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.24 -37.73 97.05 Favored 'Trans proline' 0 C--N 1.308 -1.553 0 C-N-CA 122.992 2.462 . . . . 0.0 112.386 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -81.19 -14.74 57.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.845 0.355 . . . . 0.0 110.852 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.706 ' HB3' ' HG2' ' A' ' 30' ' ' PRO . . . -140.7 62.46 18.05 Favored Pre-proline 0 N--CA 1.47 0.549 0 CA-C-O 121.534 0.683 . . . . 0.0 110.961 179.466 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -78.27 143.14 19.59 Favored 'Trans proline' 0 C--N 1.302 -1.883 0 C-N-CA 122.115 1.877 . . . . 0.0 111.48 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 84.8 mtm-85 -124.32 122.24 37.17 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -114.23 104.05 11.7 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.949 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.537 ' NH2' ' OE2' ' A' ' 28' ' ' GLU . 87.7 mtm180 -102.87 105.84 16.3 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.504 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 52.6 t -109.21 124.55 51.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.398 -179.389 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -105.43 150.02 25.64 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.919 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.463 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.1 p -120.9 119.69 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 CA-C-O 121.036 0.446 . . . . 0.0 110.243 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 96.4 m -97.23 120.48 37.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.506 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.556 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 5.1 t80 -141.68 137.8 32.01 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.266 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.556 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 3.9 m 45.32 37.32 2.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.716 179.627 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 69.68 32.62 70.84 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 111.25 -0.74 . . . . 0.0 111.25 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -135.99 125.11 24.44 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 39.9 p -105.78 107.33 18.27 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.105 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -92.5 141.07 28.92 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.019 179.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -150.49 152.3 34.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.325 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 73.2 m -95.42 160.56 14.47 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.532 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.8 m -87.2 -7.1 58.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.713 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.537 ' N ' ' OE1' ' A' ' 51' ' ' GLU . 56.3 mp0 -115.26 151.86 33.75 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.271 0.558 . . . . 0.0 110.237 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.691 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -103.53 133.7 48.12 Favored 'General case' 0 CA--C 1.505 -0.75 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.01 -179.219 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.46 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -86.19 147.16 44.28 Favored Pre-proline 0 C--N 1.308 -1.236 0 CA-C-N 114.118 -1.401 . . . . 0.0 110.831 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.84 -5.13 16.08 Favored 'Trans proline' 0 N--CA 1.498 1.756 0 C-N-CA 122.792 2.328 . . . . 0.0 112.581 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.07 155.42 50.77 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.141 0.496 . . . . 0.0 111.002 -179.379 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.68 -64.68 0.81 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.569 -178.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.4 ' HD3' ' HE2' ' A' ' 3' ' ' HIS . 15.6 ptpt -53.11 -33.45 52.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.894 0.378 . . . . 0.0 110.657 -178.009 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.2 m -57.26 -35.05 69.26 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.047 179.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.3 -41.22 70.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.27 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -62.31 -40.25 95.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.38 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.66 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -64.66 -51.17 63.95 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.204 0.526 . . . . 0.0 110.501 179.74 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.549 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -65.71 -35.73 81.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.595 -178.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.91 -48.91 79.78 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.492 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.36 -32.91 73.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.733 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -54.93 -45.86 74.88 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.851 0.357 . . . . 0.0 111.34 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.2 pt -73.74 -33.51 38.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.986 0.422 . . . . 0.0 110.548 179.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.83 -50.0 47.02 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.125 0.488 . . . . 0.0 111.64 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.2 p -64.56 -31.11 52.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.407 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.429 ' O ' ' OG1' ' A' ' 72' ' ' THR . . . -69.51 -30.2 68.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.722 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.1 t -68.45 -42.64 78.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.805 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 53.3 mt -65.59 -30.56 71.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.715 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.429 ' OG1' ' O ' ' A' ' 69' ' ' ALA . 21.4 p . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 117.976 -1.012 . . . . 0.0 110.845 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.535 ' SD ' ' N ' ' A' ' 1' ' ' MET . 2.3 mpt? . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -68.61 142.43 55.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.487 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.6 p-80 -151.53 35.52 0.56 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.516 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.4 m -85.68 -17.09 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.399 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -58.45 -44.15 89.12 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 120.805 0.336 . . . . 0.0 110.722 -179.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -58.98 -37.05 75.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.527 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.52 -26.26 59.47 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.1 mm-40 -78.66 -50.77 10.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.985 0.421 . . . . 0.0 111.091 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 35.7 tp -61.44 -42.78 99.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.582 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -63.15 -40.67 98.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.814 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.86 -37.35 79.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.385 179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -61.74 -50.01 74.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.769 -179.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.467 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.91 -47.71 79.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.942 0.401 . . . . 0.0 110.584 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.3 tp -61.6 -45.4 94.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.548 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -66.2 -41.81 89.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.649 -179.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.474 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 66.3 t-80 -86.52 -5.05 59.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.565 -179.553 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.467 ' N ' ' O ' ' A' ' 13' ' ' ALA . 44.4 t-20 60.49 65.83 1.01 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.584 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.7 mt -125.34 147.83 48.98 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.868 0.366 . . . . 0.0 110.393 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -45.41 134.37 6.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.033 0.444 . . . . 0.0 110.272 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.5 mt -46.06 143.85 3.27 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.739 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -73.0 155.44 52.8 Favored 'Trans proline' 0 C--N 1.309 -1.531 0 C-N-CA 122.733 2.289 . . . . 0.0 112.086 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.4 t -129.53 132.38 66.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.466 179.143 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -108.88 153.59 23.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.692 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.51 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -116.19 141.17 48.49 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.823 178.322 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -119.76 125.53 48.84 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.026 0.441 . . . . 0.0 110.966 -179.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -135.09 125.86 27.26 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.769 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -130.2 119.79 23.5 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.954 0.407 . . . . 0.0 110.388 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -159.57 133.05 7.13 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.184 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 146.04 149.86 5.08 Favored Glycine 0 CA--C 1.531 1.033 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -45.85 159.92 0.2 Allowed 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.661 2.241 . . . . 0.0 111.722 178.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -57.12 -44.17 46.39 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.743 2.295 . . . . 0.0 112.095 179.527 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.48 ' ND1' ' O ' ' A' ' 32' ' ' HIS . 64.1 t-80 -87.16 -0.61 56.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.203 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -141.13 61.65 14.65 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.917 178.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -81.17 145.9 15.55 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.776 2.317 . . . . 0.0 111.94 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -128.61 127.74 42.84 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.184 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -114.11 103.89 11.57 Favored 'General case' 0 C--O 1.216 -0.706 0 C-N-CA 120.338 -0.545 . . . . 0.0 111.162 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.477 ' NH2' ' OE1' ' A' ' 48' ' ' GLN . 79.5 mtp85 -104.94 104.95 14.8 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.51 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 53.7 t -110.08 128.3 55.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.42 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -108.29 152.36 24.73 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.128 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.4 HG13 ' O ' ' A' ' 40' ' ' VAL . 2.7 p -121.06 120.46 62.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.074 0.464 . . . . 0.0 110.285 -179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 54.1 m -98.85 119.31 37.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.554 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -143.05 136.24 28.17 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.369 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.47 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 42.6 t 52.21 33.63 12.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.607 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 70.33 33.9 68.66 Favored Glycine 0 CA--C 1.522 0.488 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -139.09 125.4 20.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.836 0.35 . . . . 0.0 110.338 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 33.1 m -105.48 109.79 21.89 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.046 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -95.54 141.15 29.4 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.847 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.477 ' OE1' ' NH2' ' A' ' 37' ' ' ARG . 7.1 tt0 -144.58 147.96 33.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.933 0.397 . . . . 0.0 110.42 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.423 ' OG ' ' O ' ' A' ' 51' ' ' GLU . 9.3 p -84.63 161.83 19.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.523 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 91.5 p -88.61 -6.75 57.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.554 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.423 ' O ' ' OG ' ' A' ' 49' ' ' SER . 98.8 mt-10 -122.5 157.05 32.85 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.083 0.468 . . . . 0.0 110.355 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.69 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -105.01 139.22 40.02 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.613 0.721 . . . . 0.0 110.036 -179.271 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.466 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -91.4 147.77 36.12 Favored Pre-proline 0 C--N 1.308 -1.198 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.75 -179.668 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.81 -5.3 16.27 Favored 'Trans proline' 0 C--N 1.312 -1.388 0 C-N-CA 122.838 2.359 . . . . 0.0 112.4 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.447 HG22 ' N ' ' A' ' 56' ' ' LEU . 44.1 m -132.61 155.78 48.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.266 0.555 . . . . 0.0 110.729 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.447 ' N ' HG22 ' A' ' 55' ' ' THR . 0.9 OUTLIER -69.86 -64.92 0.79 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.122 -178.676 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -52.02 -37.26 52.78 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.587 -177.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.433 ' OG ' ' O ' ' A' ' 55' ' ' THR . 78.0 p -55.0 -33.08 62.29 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 123.429 0.455 . . . . 0.0 110.382 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.47 -40.9 66.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.823 0.344 . . . . 0.0 110.925 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -64.47 -40.4 95.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.383 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -68.17 -46.08 71.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.752 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.92 -39.64 83.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.848 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.19 -48.95 79.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.728 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.32 -36.79 78.73 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.404 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -58.06 -47.7 82.36 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 86.3 mt -58.15 -47.32 87.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.318 -179.088 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.76 -44.94 76.31 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.587 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.5 t -58.54 -42.5 84.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.048 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.99 -25.97 68.37 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.539 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 6.3 t -67.49 -42.67 82.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.633 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 50.6 mt -68.42 -29.97 68.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.504 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.0 m . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.051 -0.976 . . . . 0.0 110.592 -179.74 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 ptt? . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.438 ' OD1' ' O ' ' A' ' 2' ' ' ASP . 44.4 p30 -64.13 144.85 56.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.465 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -139.12 -95.84 0.17 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.287 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.6 m -113.01 -21.91 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.895 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.651 ' CE2' ' ND1' ' A' ' 61' ' ' HIS . 17.6 m-85 -43.12 -64.79 0.57 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.88 0.371 . . . . 0.0 111.243 -179.354 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -50.83 -36.57 38.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.577 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -66.62 -36.69 91.72 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.916 -0.873 . . . . 0.0 110.916 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.8 tp60 -77.85 -49.2 14.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.988 0.423 . . . . 0.0 111.241 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 39.1 tp -60.06 -41.96 93.46 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.189 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -63.82 -41.93 97.76 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.912 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.45 -37.3 77.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.635 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.622 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 92.0 t80 -61.36 -53.56 55.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.982 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.436 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.47 -50.53 71.48 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.115 0.483 . . . . 0.0 110.653 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.52 -43.52 98.62 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.137 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -65.32 -39.26 92.21 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.584 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.622 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 60.3 m80 -89.72 -4.63 57.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.548 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.436 ' N ' ' O ' ' A' ' 13' ' ' ALA . 62.8 t30 62.36 67.13 0.74 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.521 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.3 mt -129.17 147.65 51.04 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 120.872 0.368 . . . . 0.0 110.642 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -44.18 137.52 3.41 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.192 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.9 mt -50.23 144.1 11.93 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.073 -179.073 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -70.64 151.53 64.13 Favored 'Trans proline' 0 C--N 1.312 -1.344 0 C-N-CA 122.322 2.015 . . . . 0.0 111.881 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 68.1 t -127.7 130.47 70.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.118 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -105.28 153.18 21.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.67 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.456 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -118.0 143.86 46.04 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.416 178.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -120.48 127.35 52.14 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.832 0.349 . . . . 0.0 111.207 -179.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -137.85 130.49 29.67 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.794 178.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -130.62 120.55 24.13 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.811 0.338 . . . . 0.0 110.452 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -158.76 132.51 7.57 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.203 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 148.79 143.71 3.83 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 120.6 -0.81 . . . . 0.0 111.458 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -44.1 165.5 0.04 OUTLIER 'Trans proline' 0 C--N 1.317 -1.124 0 C-N-CA 122.182 1.921 . . . . 0.0 112.431 179.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -54.22 -51.63 10.16 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.455 2.103 . . . . 0.0 112.643 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -86.07 4.27 38.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.465 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.36 61.32 19.7 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.922 179.077 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -81.87 142.74 12.74 Favored 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 122.602 2.201 . . . . 0.0 111.992 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 -131.39 129.64 41.56 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -114.07 103.4 11.09 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.167 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 90.9 mtm180 -99.73 106.48 18.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.15 0.5 . . . . 0.0 109.867 -179.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.456 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 45.0 t -110.63 122.29 47.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.358 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -105.24 152.78 22.45 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.839 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.469 ' O ' HG13 ' A' ' 40' ' ' VAL . 5.0 p -121.48 120.1 60.89 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.282 0 CA-C-O 121.111 0.482 . . . . 0.0 110.246 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 94.8 m -95.18 121.69 37.08 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.107 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.42 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.1 t80 -140.73 136.25 32.36 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.803 0.335 . . . . 0.0 110.441 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 14.2 m 43.94 32.06 0.58 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.896 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.02 33.82 44.19 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 42' ' ' PHE . 86.5 mt-30 -136.69 122.97 20.56 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 29.8 p -103.32 108.23 19.38 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.895 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -90.97 140.28 29.98 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.768 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -143.12 144.64 32.3 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.426 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 39.3 t -87.4 159.97 18.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.493 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 86.4 p -89.7 -5.82 56.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.682 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -117.81 153.26 33.78 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.18 0.514 . . . . 0.0 110.052 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.67 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -103.46 133.21 48.89 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-O 121.856 0.836 . . . . 0.0 109.917 -179.289 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.428 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -87.64 145.93 38.18 Favored Pre-proline 0 C--N 1.311 -1.099 0 CA-C-N 114.045 -1.434 . . . . 0.0 110.748 179.879 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -76.38 -5.46 16.18 Favored 'Trans proline' 0 N--CA 1.496 1.623 0 C-N-CA 122.735 2.29 . . . . 0.0 112.433 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.1 p -136.21 155.89 49.47 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.027 0.441 . . . . 0.0 110.9 -179.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.15 -64.18 0.91 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.108 -178.656 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -52.7 -34.16 50.88 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.536 -177.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.6 m -56.48 -36.02 68.64 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.274 179.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.42 -38.4 71.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.03 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.33 -43.94 96.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.526 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.651 ' ND1' ' CE2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -61.71 -50.23 73.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.171 0.51 . . . . 0.0 110.588 179.826 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.58 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -66.82 -36.06 81.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.632 -179.134 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.72 -47.95 82.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.685 -179.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.415 ' O ' HG23 ' A' ' 68' ' ' VAL . . . -68.39 -32.51 72.62 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.594 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -58.79 -53.89 53.3 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.07 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.41 HG13 ' N ' ' A' ' 67' ' ' ALA . 13.6 pt -58.6 -44.6 89.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.44 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.41 ' N ' HG13 ' A' ' 66' ' ' ILE . . . -67.7 -45.03 76.3 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.984 0.421 . . . . 0.0 110.402 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 64' ' ' ALA . 16.1 t -60.35 -42.56 91.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.65 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.08 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.2 -27.45 68.99 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.458 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.3 m -71.43 -33.86 69.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.514 179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 11.2 mt -112.92 29.51 7.91 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.149 0.5 . . . . 0.0 109.787 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.3 m . . . . . 0 C--N 1.322 -0.619 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.435 179.293 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.6 ptp . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -67.68 139.64 56.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.615 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.508 ' O ' ' CD2' ' A' ' 3' ' ' HIS . 52.3 p-80 -75.48 65.37 1.72 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.722 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.8 m -111.8 -22.73 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-O 120.7 0.286 . . . . 0.0 110.709 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -60.66 -40.97 94.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.878 0.37 . . . . 0.0 110.607 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -58.74 -40.5 84.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.544 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -70.77 -25.44 75.72 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 96.4 mm-40 -77.35 -48.62 16.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.193 0.52 . . . . 0.0 111.297 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.445 HD23 ' OH ' ' A' ' 23' ' ' TYR . 44.7 tp -62.55 -42.08 99.31 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.367 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -64.07 -42.25 97.06 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.724 -179.13 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.03 -36.82 78.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.374 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.605 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 91.2 t80 -61.73 -51.07 69.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.794 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.506 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -57.58 -48.02 80.53 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.01 0.433 . . . . 0.0 110.369 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.1 tp -62.74 -44.77 95.34 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.529 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -64.98 -38.97 92.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.689 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.605 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 64.6 m80 -93.09 -1.23 56.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.614 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.506 ' N ' ' O ' ' A' ' 13' ' ' ALA . 81.9 m-20 55.92 65.29 1.48 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.532 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.2 mt -122.02 149.49 43.43 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.03 0.443 . . . . 0.0 110.326 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.515 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 55.6 mp0 -41.3 151.54 0.07 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.579 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.487 HD22 ' N ' ' A' ' 20' ' ' LEU . 3.5 mm? -61.54 137.74 94.86 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.914 -178.664 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.28 154.54 56.46 Favored 'Trans proline' 0 C--N 1.317 -1.101 0 C-N-CA 122.069 1.846 . . . . 0.0 112.004 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 68.6 t -133.17 134.87 57.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.537 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.445 ' OH ' HD23 ' A' ' 9' ' ' LEU . 29.5 m-85 -111.88 152.1 28.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.898 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.491 ' HB3' ' H ' ' A' ' 39' ' ' ASN . . . -109.84 144.78 37.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.079 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -127.08 120.34 28.72 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.915 0.388 . . . . 0.0 111.354 -179.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -133.45 127.66 33.8 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -131.18 119.23 21.57 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 120.719 0.295 . . . . 0.0 110.378 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -159.67 134.78 8.1 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 120.45 -0.5 . . . . 0.0 109.812 179.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 147.44 147.67 4.59 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 120.468 -0.872 . . . . 0.0 111.559 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -45.19 160.92 0.11 Allowed 'Trans proline' 0 N--CA 1.491 1.377 0 C-N-CA 122.389 2.06 . . . . 0.0 111.74 178.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -57.02 -43.42 54.05 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 122.864 2.376 . . . . 0.0 111.952 179.358 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -88.43 0.49 56.18 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.319 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.32 60.52 14.57 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.901 179.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -78.54 143.03 18.84 Favored 'Trans proline' 0 C--N 1.307 -1.632 0 C-N-CA 122.443 2.095 . . . . 0.0 112.048 179.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 87.9 mtm-85 -129.64 127.36 40.43 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -114.51 103.83 11.42 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 120.146 -0.622 . . . . 0.0 110.977 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.514 HH12 ' C ' ' A' ' 50' ' ' SER . 33.7 mmt180 -104.38 105.29 15.36 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.29 0.566 . . . . 0.0 110.03 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 74.1 m -114.23 134.18 55.1 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.309 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.491 ' H ' ' HB3' ' A' ' 24' ' ' ALA . 59.6 m-20 -110.14 157.89 18.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.353 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 p -122.42 120.75 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-O 121.202 0.525 . . . . 0.0 110.108 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 52.0 m -102.73 119.86 39.57 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.439 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.516 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.4 t80 -143.91 138.54 28.62 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.183 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.451 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 48.7 t 42.62 32.77 0.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.811 0.338 . . . . 0.0 110.909 179.774 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.27 30.27 59.0 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.516 ' N ' ' O ' ' A' ' 42' ' ' PHE . 99.1 mm-40 -125.19 119.23 27.95 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.817 0.342 . . . . 0.0 110.245 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 26.3 p -109.78 100.73 9.69 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.555 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -107.85 143.24 36.72 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.417 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.43 ' OE1' ' OD1' ' A' ' 39' ' ' ASN . 18.0 pt20 -153.52 154.04 33.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.772 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.3 p -82.35 162.21 22.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.403 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.514 ' C ' HH12 ' A' ' 37' ' ' ARG . 91.2 p -92.11 -3.11 56.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.577 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -109.77 153.28 24.57 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.239 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.629 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 1.0 OUTLIER -102.23 122.85 45.0 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 121.735 0.779 . . . . 0.0 109.923 -179.228 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.409 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.6 OUTLIER -78.34 148.98 75.05 Favored Pre-proline 0 C--N 1.306 -1.303 0 CA-C-N 114.144 -1.389 . . . . 0.0 110.748 -179.847 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -77.72 -6.48 16.12 Favored 'Trans proline' 0 N--CA 1.493 1.466 0 C-N-CA 122.628 2.218 . . . . 0.0 112.35 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -136.11 153.52 51.28 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.981 0.42 . . . . 0.0 110.384 -179.308 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.64 -60.32 3.48 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.007 -179.231 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -55.02 -34.09 63.19 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.927 -177.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.9 m -57.13 -35.88 70.01 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.206 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.53 -47.81 52.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.813 0.339 . . . . 0.0 111.283 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -62.56 -42.1 99.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.356 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -66.32 -45.74 79.27 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.683 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.45 -38.35 84.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.714 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.72 -48.0 82.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.552 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.452 ' O ' HG12 ' A' ' 68' ' ' VAL . . . -58.4 -38.69 77.86 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.402 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -55.12 -43.21 73.88 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.007 0.432 . . . . 0.0 110.107 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 62.4 mt -68.13 -42.95 85.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.439 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.413 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -65.48 -49.31 69.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.032 0.444 . . . . 0.0 111.657 -178.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.452 HG12 ' O ' ' A' ' 64' ' ' ALA . 8.8 p -67.25 -29.02 44.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.369 -179.495 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.8 -27.42 62.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.825 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 83.6 p -73.77 -38.31 64.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.051 0.453 . . . . 0.0 110.522 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 63.7 mt -67.2 -30.63 70.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.617 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 20.7 p . . . . . 0 C--N 1.325 -0.488 0 CA-C-O 117.958 -1.02 . . . . 0.0 110.782 -179.894 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.2 mtp . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -61.84 -43.59 98.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.517 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 39.08 42.37 0.69 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.088 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.415 ' H ' HG22 ' A' ' 4' ' ' VAL . 15.3 m -83.77 -16.38 11.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.991 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.657 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 4.3 m-85 -61.27 -42.54 98.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.738 -179.221 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -59.35 -42.66 92.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.372 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.44 -24.29 63.43 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 111.229 -0.748 . . . . 0.0 111.229 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -76.92 -48.61 17.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.0 0.428 . . . . 0.0 110.938 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 33.6 tp -62.95 -41.52 99.53 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.09 -179.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -62.01 -41.75 98.4 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 119.701 -0.8 . . . . 0.0 110.614 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.61 -36.4 80.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.631 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.621 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 76.2 t80 -61.25 -51.18 70.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.596 -179.35 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.76 -48.96 76.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.084 0.468 . . . . 0.0 110.23 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.1 tp -62.68 -43.81 97.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.462 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -64.0 -40.31 96.08 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.626 -179.045 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 62.8 m80 -90.56 -4.94 56.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.63 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.476 ' N ' ' O ' ' A' ' 13' ' ' ALA . 63.3 t30 62.98 66.62 0.73 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.611 179.547 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.7 mt -127.67 148.3 50.39 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.457 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -45.78 136.94 5.8 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.932 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.0 mt -47.31 143.89 4.81 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.993 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -72.66 155.92 53.91 Favored 'Trans proline' 0 N--CA 1.494 1.509 0 C-N-CA 122.465 2.11 . . . . 0.0 112.016 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 74.9 t -129.58 130.34 67.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.445 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -106.55 152.4 23.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.333 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.453 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -113.68 145.86 40.69 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.388 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -125.02 121.96 35.89 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.742 0.306 . . . . 0.0 111.146 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -131.77 129.4 40.52 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 177.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.6 ttt-85 -130.84 118.55 20.94 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -158.34 134.05 8.97 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.532 -0.467 . . . . 0.0 109.894 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.04 142.96 3.69 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 120.219 -0.991 . . . . 0.0 111.536 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -43.88 164.94 0.04 OUTLIER 'Trans proline' 0 N--CA 1.488 1.206 0 C-N-CA 121.766 1.644 . . . . 0.0 112.392 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.6 -48.28 22.71 Favored 'Trans proline' 0 N--CA 1.499 1.848 0 C-N-CA 122.424 2.083 . . . . 0.0 112.715 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -88.97 4.88 46.63 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.579 -179.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.35 61.05 18.55 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.838 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -80.05 141.52 14.85 Favored 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.471 2.114 . . . . 0.0 111.65 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -131.0 129.37 41.99 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 178.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -114.89 104.15 11.64 Favored 'General case' 0 CA--C 1.508 -0.642 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.187 179.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.8 mtp180 -100.52 105.94 17.43 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.674 -0.41 . . . . 0.0 109.9 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.453 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 44.1 t -110.63 125.26 53.24 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 120.96 0.41 . . . . 0.0 110.37 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -108.02 155.62 20.15 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.152 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.457 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.3 p -123.27 120.04 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.086 0.47 . . . . 0.0 110.347 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 95.4 m -97.92 119.27 36.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.233 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.491 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 5.3 t80 -140.07 139.44 35.9 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.337 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.491 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 6.2 m 44.11 32.25 0.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.6 32.32 54.67 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.496 -0.642 . . . . 0.0 111.496 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 42' ' ' PHE . 84.7 mt-30 -134.75 120.69 19.74 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.766 0.317 . . . . 0.0 110.253 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.2 m -102.72 107.68 18.65 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 121.02 0.438 . . . . 0.0 110.885 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -91.16 141.12 29.15 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.157 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -142.71 139.11 30.99 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.522 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.9 p -81.77 162.69 22.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.436 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.9 m -90.63 -9.24 47.69 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.732 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -120.99 142.37 49.85 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.266 0.555 . . . . 0.0 110.602 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.573 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.0 140.19 29.9 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.956 -179.368 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.411 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -92.33 147.93 35.49 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 114.711 -1.131 . . . . 0.0 111.12 -179.701 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -77.03 -4.61 15.07 Favored 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 122.807 2.338 . . . . 0.0 112.582 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.02 154.29 51.24 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.243 0.544 . . . . 0.0 111.143 -179.194 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.67 -64.86 0.78 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.632 -178.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -56.1 -35.45 67.04 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 120.731 0.301 . . . . 0.0 110.567 -177.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 40.2 t -56.45 -34.19 66.62 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.986 179.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.88 -39.46 79.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.27 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -62.43 -41.73 98.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.6 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.657 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -62.01 -52.17 65.06 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.162 0.506 . . . . 0.0 110.446 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.567 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -64.97 -37.24 86.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.743 -178.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.59 -45.46 91.81 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.437 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.482 ' O ' HG23 ' A' ' 68' ' ' VAL . . . -68.16 -34.09 75.67 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.906 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -59.35 -52.8 64.08 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 121.092 -0.243 . . . . 0.0 111.421 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.403 HG13 ' N ' ' A' ' 67' ' ' ALA . 12.4 pt -57.82 -45.57 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.124 -179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.403 ' N ' HG13 ' A' ' 66' ' ' ILE . . . -66.88 -43.36 83.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.083 0.468 . . . . 0.0 110.659 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 64' ' ' ALA . 18.4 t -60.6 -42.71 92.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.064 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.67 -27.72 69.42 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.696 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.4 m -67.56 -40.98 84.93 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.818 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 57.6 mt -66.77 -30.62 70.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.481 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 21.7 m . . . . . 0 C--N 1.325 -0.46 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.76 179.959 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 39.8 ttm . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -77.07 153.03 34.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.654 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.621 ' ND1' ' CE1' ' A' ' 61' ' ' HIS . 85.9 t60 55.54 50.66 14.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.009 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.8 m -109.76 -11.58 11.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 121.013 0.435 . . . . 0.0 110.738 179.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -60.91 -44.52 97.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.653 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -59.83 -42.55 93.8 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.598 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.47 -34.92 91.2 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -74.99 -44.51 47.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.063 0.459 . . . . 0.0 111.053 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.453 HD23 ' OH ' ' A' ' 23' ' ' TYR . 49.1 tp -62.97 -40.79 98.78 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.199 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -66.29 -40.06 89.8 Favored 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 119.901 -0.72 . . . . 0.0 110.785 -179.566 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.28 -40.15 89.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.449 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -62.91 -48.18 80.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.67 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.71 -40.27 62.84 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.381 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.3 tp -63.49 -44.84 93.2 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.429 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.6 tp60 -70.29 -41.01 73.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.989 0.424 . . . . 0.0 111.122 -178.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.463 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 58.7 t-80 -74.0 -14.0 60.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.608 -179.579 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 54.83 69.0 0.78 Allowed 'General case' 0 C--O 1.233 0.198 0 C-N-CA 120.886 -0.325 . . . . 0.0 111.762 178.546 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -147.07 169.45 19.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.316 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -43.37 131.37 4.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.183 178.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.498 ' N ' HD12 ' A' ' 20' ' ' LEU . 10.9 mp -53.94 152.35 10.54 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.717 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -66.82 148.61 82.77 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 C-N-CA 122.447 2.098 . . . . 0.0 112.085 179.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 75.0 t -132.84 132.2 59.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.561 179.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.453 ' OH ' HD23 ' A' ' 9' ' ' LEU . 32.1 m-85 -107.99 151.32 25.98 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.468 179.376 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -126.16 131.96 51.92 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.047 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -112.65 137.61 50.67 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.854 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -139.84 150.39 44.61 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.6 ttt-85 -120.84 127.41 51.89 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -162.78 105.95 1.07 Allowed 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.894 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 167.3 -175.12 42.47 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 120.285 -0.959 . . . . 0.0 111.028 -179.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -45.06 155.7 0.31 Allowed 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.54 2.16 . . . . 0.0 111.599 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.31 -57.47 0.26 Allowed 'Trans proline' 0 N--CA 1.5 1.885 0 C-N-CA 122.504 2.136 . . . . 0.0 112.678 -179.273 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.46 ' O ' ' CG ' ' A' ' 32' ' ' HIS . 83.2 t60 -84.87 -6.48 59.35 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.465 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -144.01 62.56 10.62 Favored Pre-proline 0 CA--C 1.531 0.243 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -75.03 157.83 42.44 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 C-N-CA 122.771 2.314 . . . . 0.0 112.578 -179.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -104.27 145.92 29.54 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -112.49 105.17 13.34 Favored 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 120.565 -0.454 . . . . 0.0 111.648 -178.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 -101.4 108.65 20.31 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 62.0 m -115.01 143.67 44.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.921 0.391 . . . . 0.0 110.633 -179.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.527 ' ND2' ' OE1' ' A' ' 48' ' ' GLN . 8.6 m-20 -116.36 157.52 24.91 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.949 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.452 ' O ' HG13 ' A' ' 40' ' ' VAL . 3.7 p -124.31 121.06 60.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.928 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 64.7 m -96.37 124.67 40.45 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.622 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.478 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.1 t80 -146.35 139.64 25.8 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.238 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.495 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 42.9 t 42.99 32.79 0.45 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.915 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 74.98 28.06 63.26 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 42' ' ' PHE . 87.0 mt-30 -131.32 130.85 43.27 Favored 'General case' 0 C--O 1.233 0.211 0 O-C-N 122.724 -0.28 . . . . 0.0 110.42 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 63.6 p -108.76 104.63 13.95 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.968 0.414 . . . . 0.0 110.879 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -89.83 140.68 29.37 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.964 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.527 ' OE1' ' ND2' ' A' ' 39' ' ' ASN . 27.4 mt-30 -141.01 154.77 46.16 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.313 -179.719 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 42.8 m -100.45 157.78 16.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.52 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.9 t -89.53 -2.6 58.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.718 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -116.85 136.34 53.03 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.268 0.556 . . . . 0.0 110.308 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.579 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.68 144.95 24.81 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.71 -179.578 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.55 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -105.97 148.05 35.86 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 114.623 -1.171 . . . . 0.0 111.085 179.783 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.87 -3.54 13.61 Favored 'Trans proline' 0 N--CA 1.5 1.891 0 C-N-CA 122.938 2.425 . . . . 0.0 112.64 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.429 HG22 ' N ' ' A' ' 56' ' ' LEU . 89.3 m -134.88 154.24 51.74 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.04 0.447 . . . . 0.0 111.24 -179.187 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.429 ' N ' HG22 ' A' ' 55' ' ' THR . 0.4 OUTLIER -65.19 -62.98 1.22 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.506 -178.706 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.473 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 98.5 mttt -54.1 -33.57 58.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.738 0.304 . . . . 0.0 110.593 -177.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.5 m -56.95 -34.71 68.29 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.434 -0.507 . . . . 0.0 110.032 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.448 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -73.1 -44.28 60.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.45 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.25 -41.92 94.23 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.741 -179.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.621 ' CE1' ' ND1' ' A' ' 3' ' ' HIS . 0.3 OUTLIER -61.81 -49.67 75.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.662 -179.727 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.51 -33.75 74.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.84 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.13 -49.19 77.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.825 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.67 -31.29 70.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.625 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -54.68 -46.21 74.03 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 121.124 -0.23 . . . . 0.0 110.75 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 23.3 pt -74.92 -30.88 24.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.817 0.341 . . . . 0.0 110.654 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.94 -52.07 22.08 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.125 0.488 . . . . 0.0 111.672 -179.075 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.1 p -61.71 -31.02 49.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.355 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.04 -28.64 64.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.731 179.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 78.0 p -69.27 -39.31 78.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.734 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 42.5 mt -68.26 -30.93 70.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.511 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 22.1 p . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 118.161 -0.924 . . . . 0.0 110.782 -179.934 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.2 mtp . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -90.64 114.21 26.44 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.391 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.518 ' ND1' ' CD2' ' A' ' 61' ' ' HIS . 2.7 m-70 -69.12 73.85 0.31 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.532 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.0 m -95.64 -16.33 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 CA-C-N 116.561 -0.291 . . . . 0.0 110.742 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -56.22 -45.76 79.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.848 0.356 . . . . 0.0 111.067 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -59.99 -41.57 92.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.579 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.84 -30.79 72.49 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.48 -0.648 . . . . 0.0 111.48 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 -76.81 -48.91 17.12 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.213 0.53 . . . . 0.0 110.631 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.2 tp -61.97 -42.59 99.31 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.507 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -65.29 -40.93 94.46 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.531 -179.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.76 -39.29 76.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.807 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.467 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 90.3 t80 -61.86 -49.93 74.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.151 -179.376 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.405 ' HB2' ' HZ ' ' A' ' 42' ' ' PHE . . . -55.89 -52.25 64.73 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.19 0.519 . . . . 0.0 110.592 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.68 -42.93 97.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.828 -179.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -53.71 -39.42 65.2 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.67 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.467 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 77.7 m80 -97.79 2.75 49.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.587 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.594 ' C ' HD12 ' A' ' 18' ' ' LEU . 62.3 t30 64.54 67.37 0.57 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.022 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.594 HD12 ' C ' ' A' ' 17' ' ' ASN . 9.5 mp -115.21 -172.97 2.23 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.545 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -91.77 139.77 30.35 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.941 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.588 ' N ' HD12 ' A' ' 20' ' ' LEU . 10.2 mp -47.53 141.9 6.7 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.03 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.98 158.19 42.42 Favored 'Trans proline' 0 N--CA 1.495 1.578 0 C-N-CA 122.87 2.38 . . . . 0.0 111.824 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.6 t -129.96 134.65 62.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.547 179.481 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -114.24 154.64 27.57 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.238 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -118.67 144.51 46.15 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.0 178.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -123.86 125.38 44.56 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.254 0.55 . . . . 0.0 111.162 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -134.39 127.75 32.23 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.221 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -128.87 120.37 26.11 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.187 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -158.55 132.42 7.72 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.51 140.74 3.31 Favored Glycine 0 CA--C 1.534 1.233 0 C-N-CA 120.493 -0.86 . . . . 0.0 111.072 179.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -43.44 167.14 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.417 2.078 . . . . 0.0 112.92 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.06 -50.56 13.19 Favored 'Trans proline' 0 N--CA 1.5 1.856 0 C-N-CA 122.883 2.388 . . . . 0.0 113.059 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 52.6 p-80 -89.42 4.52 48.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.696 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.66 61.52 19.5 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.813 179.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -81.87 143.16 12.96 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.624 2.216 . . . . 0.0 112.043 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -132.35 128.93 38.7 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -113.86 104.16 11.91 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.756 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -103.58 105.82 16.16 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.108 0.48 . . . . 0.0 109.978 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 69.4 m -115.28 133.39 56.08 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.119 0.485 . . . . 0.0 111.26 -179.27 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -110.27 153.36 24.95 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.522 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.473 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.2 p -120.48 119.83 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.316 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.6 m -97.32 119.64 36.21 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.377 179.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.405 ' HZ ' ' HB2' ' A' ' 13' ' ' ALA . 7.2 t80 -143.18 139.63 30.41 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.462 -179.619 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.423 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 49.5 t 47.98 32.28 2.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.842 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.99 31.38 61.98 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -137.43 132.68 33.76 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 40.9 p -108.71 107.01 17.3 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.032 -179.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.42 ' HZ ' ' HG ' ' A' ' 70' ' ' SER . 48.0 m-85 -93.1 140.88 29.03 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.885 179.743 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -151.5 146.9 26.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.337 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.0 p -85.57 164.31 17.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.695 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.0 p -90.24 -2.02 57.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.833 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -124.45 143.19 50.77 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.407 0.623 . . . . 0.0 110.808 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.644 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -91.45 143.14 26.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.54 -179.33 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.513 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -96.2 149.29 35.73 Favored Pre-proline 0 C--N 1.318 -0.8 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.132 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -77.23 -3.59 13.86 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 123.182 2.588 . . . . 0.0 112.752 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.424 ' O ' ' OG ' ' A' ' 58' ' ' SER . 0.8 OUTLIER -134.31 155.9 49.41 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.238 0.542 . . . . 0.0 110.757 -179.508 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.4 -66.01 0.65 Allowed 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.493 -178.422 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -53.22 -34.19 56.01 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.603 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.424 ' OG ' ' O ' ' A' ' 55' ' ' THR . 77.4 p -57.63 -33.27 68.09 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.579 179.717 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.41 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -71.11 -40.87 71.22 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.941 0.401 . . . . 0.0 110.888 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -65.37 -40.32 93.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.402 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.518 ' CD2' ' ND1' ' A' ' 3' ' ' HIS . 6.9 m-70 -62.98 -50.31 71.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.749 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.25 -34.46 78.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.761 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.32 -46.35 86.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.598 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.77 -33.67 75.29 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.823 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 53.9 tttp -54.11 -46.03 72.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.587 0.232 . . . . 0.0 110.845 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.2 pt -74.84 -29.55 22.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.679 179.344 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.89 -51.49 25.88 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.471 -179.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.0 p -63.36 -29.01 46.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.281 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.82 -31.22 67.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 0.0 110.68 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.42 ' HG ' ' HZ ' ' A' ' 47' ' ' PHE . 37.1 t -66.29 -42.92 87.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.675 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 52.3 mt -66.11 -30.19 70.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.696 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 29.3 m . . . . . 0 C--O 1.22 -0.475 0 CA-C-O 118.095 -0.955 . . . . 0.0 110.406 -179.885 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.9 ptm . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' A' ' 2' ' ' ASP . 63.9 t0 -62.06 -39.72 93.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.557 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.1 m170 45.11 85.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.452 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.401 HG22 ' H ' ' A' ' 4' ' ' VAL . 31.3 m -89.79 -18.63 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-O 120.863 0.363 . . . . 0.0 110.756 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.523 ' CE1' ' NE2' ' A' ' 61' ' ' HIS . 4.4 m-85 -53.58 -45.02 69.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.792 -179.103 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -62.12 -41.09 97.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.637 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.48 -30.36 56.7 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.249 -0.741 . . . . 0.0 111.249 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -75.63 -47.32 26.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.808 0.337 . . . . 0.0 111.106 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 35.0 tp -61.56 -43.13 99.43 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.385 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -64.25 -41.52 96.92 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.836 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.06 -36.96 78.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.584 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.631 ' CE2' ' CE1' ' A' ' 16' ' ' HIS . 50.0 t80 -59.73 -50.69 72.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.823 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.4 -48.34 77.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.489 179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 47.7 tp -62.02 -43.71 98.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.611 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -63.69 -39.3 93.98 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.712 -179.387 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.631 ' CE1' ' CE2' ' A' ' 12' ' ' TYR . 57.8 m80 -89.36 2.48 54.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.549 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 61.6 t30 60.0 61.66 1.83 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.526 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.8 mt -131.2 148.52 52.71 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.599 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -48.29 134.67 14.48 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.016 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.556 ' N ' HD12 ' A' ' 20' ' ' LEU . 10.1 mp -48.51 150.02 2.6 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.858 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.92 152.57 63.43 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 C-N-CA 122.587 2.191 . . . . 0.0 111.934 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 79.6 t -129.2 128.76 67.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.415 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -104.82 152.49 22.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.402 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.532 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -126.0 132.68 51.97 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.207 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -110.39 136.44 49.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.956 0.407 . . . . 0.0 110.882 -178.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -139.74 149.69 43.91 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.022 179.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -124.78 129.45 50.48 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.7 tm-20 -165.01 108.45 0.86 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.114 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 165.94 -173.16 41.51 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.044 -0.823 . . . . 0.0 111.044 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.448 ' O ' ' N ' ' A' ' 34' ' ' PRO . 76.5 Cg_exo -45.64 130.05 11.95 Favored 'Trans proline' 0 C--N 1.309 -1.541 0 C-N-CA 122.698 2.265 . . . . 0.0 111.798 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_exo -46.12 -56.96 2.48 Favored 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 122.276 1.984 . . . . 0.0 113.099 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -78.34 -11.8 59.96 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.74 -179.388 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -144.66 67.4 14.1 Favored Pre-proline 0 CA--C 1.541 0.598 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.448 ' N ' ' O ' ' A' ' 30' ' ' PRO . 64.0 Cg_endo -77.82 156.6 31.16 Favored 'Trans proline' 0 C--N 1.3 -1.989 0 C-N-CA 122.608 2.206 . . . . 0.0 112.766 -178.762 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -101.26 145.35 28.96 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -111.49 106.84 15.85 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-O 121.203 0.525 . . . . 0.0 111.938 -179.049 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -100.28 108.28 20.3 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.532 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 35.3 t -111.74 134.5 53.27 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.834 -179.169 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -112.54 157.58 20.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.225 179.634 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.465 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.9 p -122.49 120.57 61.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-O 120.87 0.367 . . . . 0.0 110.277 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 93.8 m -95.66 121.17 37.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.562 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -144.1 132.28 21.8 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.019 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.476 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 44.9 t 49.43 32.21 4.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.904 0.383 . . . . 0.0 110.878 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.03 31.54 57.65 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 111.467 -0.653 . . . . 0.0 111.467 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -134.31 128.86 34.6 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 76.2 p -107.73 106.87 17.38 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.027 -179.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -92.82 142.23 27.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.122 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -138.39 160.08 40.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.376 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.9 t -100.32 161.12 13.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.437 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.0 p -90.99 -5.94 54.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.562 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.545 ' N ' ' OE1' ' A' ' 51' ' ' GLU . 55.9 mp0 -117.72 139.89 50.41 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.114 0.483 . . . . 0.0 110.495 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.576 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.62 145.32 24.91 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.919 -179.166 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.524 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -107.9 147.19 34.99 Favored Pre-proline 0 C--N 1.315 -0.913 0 CA-C-N 115.014 -0.993 . . . . 0.0 111.065 179.763 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -77.91 -3.41 13.48 Favored 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 122.736 2.291 . . . . 0.0 112.555 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 p -134.26 153.98 51.55 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.007 0.432 . . . . 0.0 111.064 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.17 -63.76 1.01 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.275 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -52.31 -34.41 46.8 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.995 -177.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 34.6 m -57.55 -33.39 68.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.856 0.36 . . . . 0.0 110.527 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.432 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -72.74 -46.22 54.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.164 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -59.04 -34.93 72.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.432 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.523 ' NE2' ' CE1' ' A' ' 5' ' ' TYR . 2.7 t-80 -62.31 -60.01 4.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.872 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.406 ' N ' ' ND1' ' A' ' 61' ' ' HIS . . . -64.91 -34.92 79.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.772 -179.365 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.98 -52.6 65.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.955 -179.092 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.58 -39.58 80.74 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.81 -179.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -57.18 -48.71 78.07 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.668 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 96.7 mt -56.82 -46.99 83.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.304 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.94 -45.8 73.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.025 0.44 . . . . 0.0 110.431 179.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.0 t -57.04 -41.25 77.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.004 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -66.49 -27.24 67.63 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.827 0.346 . . . . 0.0 110.675 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.4 m -67.77 -40.15 84.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.734 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 49.9 mt -67.91 -30.08 69.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.429 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.1 t . . . . . 0 C--O 1.219 -0.534 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.686 -179.561 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.0 mtt . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -88.86 110.25 20.9 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.469 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 75.6 t60 -74.78 69.76 1.84 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.669 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.5 m -104.25 -13.89 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 CA-C-O 120.784 0.326 . . . . 0.0 110.855 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.657 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 5.7 m-85 -58.24 -45.58 87.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.717 -179.185 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -59.43 -41.98 90.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.969 0.414 . . . . 0.0 110.253 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.57 -32.54 83.59 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -76.51 -47.38 22.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.007 0.432 . . . . 0.0 111.158 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.8 tp -62.2 -42.55 99.4 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.303 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -62.61 -41.4 98.97 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 119.692 -0.803 . . . . 0.0 110.691 -178.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.42 -37.39 82.98 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.572 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.617 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 63.0 t80 -61.32 -50.96 70.87 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.669 -179.497 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.77 -47.28 80.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.971 0.415 . . . . 0.0 110.266 -179.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.5 tp -62.16 -45.38 93.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.503 -179.21 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -65.01 -38.18 90.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.506 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.617 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 62.4 m80 -91.17 2.28 56.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.536 -179.736 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 54.53 65.04 1.61 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.686 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.5 mt -127.65 151.32 49.09 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.089 0.471 . . . . 0.0 110.567 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -47.68 139.26 7.4 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.845 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 pp -52.68 146.19 18.82 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.902 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -72.35 153.24 55.92 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 122.5 2.133 . . . . 0.0 112.119 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.5 t -129.79 131.21 66.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.523 179.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -106.99 152.41 24.02 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.34 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -128.18 110.72 12.7 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 178.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.448 ' OD1' ' O ' ' A' ' 25' ' ' ASN . 40.7 p30 -107.3 144.14 34.56 Favored 'General case' 0 CA--C 1.517 -0.302 0 O-C-N 123.713 0.633 . . . . 0.0 110.987 -178.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.451 ' OE1' ' N ' ' A' ' 27' ' ' ARG . 0.7 OUTLIER -145.04 148.63 33.91 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.252 178.786 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.451 ' N ' ' OE1' ' A' ' 26' ' ' GLU . 61.7 ttp180 -129.82 125.13 35.0 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.648 0.261 . . . . 0.0 110.432 179.757 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -160.01 130.33 5.51 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.459 -0.497 . . . . 0.0 109.745 179.539 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.49 143.77 3.82 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 120.354 -0.927 . . . . 0.0 111.272 179.282 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -43.67 167.68 0.03 OUTLIER 'Trans proline' 0 N--CA 1.489 1.23 0 C-N-CA 122.022 1.814 . . . . 0.0 112.446 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -55.68 -52.72 6.9 Favored 'Trans proline' 0 N--CA 1.5 1.857 0 C-N-CA 122.485 2.123 . . . . 0.0 112.501 179.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -86.04 5.53 33.06 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.663 -179.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.0 60.02 16.83 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.833 178.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -77.93 139.52 17.47 Favored 'Trans proline' 0 C--N 1.311 -1.426 0 C-N-CA 122.599 2.199 . . . . 0.0 111.755 178.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.9 mmt180 -128.78 129.42 45.64 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.254 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -115.04 102.19 9.7 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.332 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 85.7 mtp180 -101.16 106.93 18.22 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 9.9 t -114.87 129.21 56.66 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.016 -179.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -109.39 157.79 18.57 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.665 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.477 ' O ' HG13 ' A' ' 40' ' ' VAL . 5.4 p -125.24 121.32 60.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.196 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 99.1 m -98.52 123.93 42.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.737 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -146.23 132.81 19.81 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.312 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.476 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 51.8 t 47.84 45.14 18.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.837 0.351 . . . . 0.0 110.615 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 61.7 31.55 78.41 Favored Glycine 0 CA--C 1.522 0.505 0 N-CA-C 111.244 -0.742 . . . . 0.0 111.244 179.047 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.432 ' CG ' ' CE1' ' A' ' 47' ' ' PHE . 11.9 tp-100 -136.81 123.31 20.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.843 0.354 . . . . 0.0 110.167 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.97 109.62 21.68 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.299 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.472 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 60.0 m-85 -91.99 141.04 29.05 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.971 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.468 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 2.6 pm0 -149.71 156.02 41.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.176 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.6 t -96.52 170.75 9.0 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.429 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.5 p -99.21 -0.35 41.64 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.543 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -128.23 129.69 46.8 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.187 0.518 . . . . 0.0 110.706 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.92 148.0 32.85 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.992 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.479 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -99.2 147.62 33.52 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.165 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -74.88 -6.89 18.71 Favored 'Trans proline' 0 N--CA 1.497 1.71 0 C-N-CA 122.741 2.294 . . . . 0.0 112.457 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 p -133.45 155.0 50.33 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.221 0.534 . . . . 0.0 111.095 -179.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.77 -64.16 0.91 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.425 -178.549 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -53.71 -33.05 54.27 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.805 0.336 . . . . 0.0 110.381 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.4 t -56.92 -36.93 70.77 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.026 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.422 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -68.8 -45.45 71.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.457 -179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.62 -39.48 84.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.29 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.657 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -64.32 -52.45 58.39 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.256 0.55 . . . . 0.0 110.735 179.949 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.566 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -65.63 -36.0 82.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.111 -178.553 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.81 -49.28 78.28 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.569 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.62 -32.1 70.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.787 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -54.77 -45.37 74.23 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.675 0.274 . . . . 0.0 110.832 -179.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 23.1 pt -74.08 -34.43 38.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 120.935 0.397 . . . . 0.0 110.677 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.53 -50.63 43.22 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.032 0.444 . . . . 0.0 111.666 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.5 p -63.07 -32.38 56.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.2 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.32 -28.08 65.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.57 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.472 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 18.5 m -68.93 -41.24 78.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.688 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 53.4 mt -67.27 -30.48 70.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.697 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.529 179.962 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.1 ttp . . . . . 0 N--CA 1.489 1.504 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -67.82 142.62 56.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.391 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.555 ' CG ' ' CG ' ' A' ' 61' ' ' HIS . 98.2 m-70 -107.91 120.08 41.26 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.563 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.1 m -109.36 -10.98 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.081 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.674 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -60.33 -45.97 91.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.684 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -61.08 -45.11 96.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.458 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.0 -34.84 90.95 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -73.24 -44.57 59.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.87 0.367 . . . . 0.0 111.227 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 45.6 tp -62.92 -41.19 99.38 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.417 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -64.37 -41.24 96.82 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 119.868 -0.733 . . . . 0.0 110.515 -179.472 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.73 -37.97 82.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.991 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.613 ' CE1' ' CD2' ' A' ' 16' ' ' HIS . 71.4 t80 -61.52 -50.69 71.69 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.825 -179.338 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.418 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -55.73 -47.69 76.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.931 0.396 . . . . 0.0 110.329 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.8 tt -63.16 -43.01 99.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.979 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -64.14 -40.97 97.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.627 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.613 ' CD2' ' CE1' ' A' ' 12' ' ' TYR . 78.7 m-70 -89.49 -4.24 58.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.765 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.418 ' N ' ' O ' ' A' ' 13' ' ' ALA . 64.7 t30 61.3 65.32 0.98 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.571 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 78.9 mt -128.51 148.83 50.77 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.601 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.594 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 1.5 mp0 -47.29 147.8 1.47 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.828 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.89 145.28 53.87 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.866 -179.099 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.68 153.02 64.96 Favored 'Trans proline' 0 N--CA 1.495 1.561 0 C-N-CA 122.4 2.067 . . . . 0.0 111.772 179.67 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 64.7 t -127.67 130.69 70.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.33 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -107.45 148.69 28.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.695 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.46 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -124.65 111.39 15.56 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.598 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.502 ' OD1' ' SG ' ' A' ' 38' ' ' CYS . 45.3 m-80 -109.88 143.55 39.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.735 0.302 . . . . 0.0 110.612 -178.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -148.0 151.25 35.44 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -113.12 134.62 54.46 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.587 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.509 ' OE2' ' NE ' ' A' ' 37' ' ' ARG . 4.9 pt-20 -164.63 109.81 0.96 Allowed 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.662 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 164.94 -171.22 40.28 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.402 -0.904 . . . . 0.0 111.263 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.423 ' O ' ' N ' ' A' ' 34' ' ' PRO . 76.3 Cg_exo -45.18 129.92 10.61 Favored 'Trans proline' 0 C--N 1.307 -1.632 0 C-N-CA 122.18 1.92 . . . . 0.0 111.487 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -46.1 -54.86 4.18 Favored 'Trans proline' 0 N--CA 1.497 1.706 0 C-N-CA 122.128 1.886 . . . . 0.0 113.099 -179.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 62.4 t-80 -81.76 -11.26 59.09 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.256 -179.098 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -143.56 63.52 12.42 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.423 ' N ' ' O ' ' A' ' 30' ' ' PRO . 58.0 Cg_endo -74.07 155.68 47.47 Favored 'Trans proline' 0 N--CA 1.495 1.577 0 C-N-CA 122.426 2.084 . . . . 0.0 112.626 -178.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -101.81 144.29 30.66 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -111.39 105.98 14.76 Favored 'General case' 0 CA--C 1.5 -0.97 0 C-N-CA 120.266 -0.573 . . . . 0.0 111.744 -178.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.509 ' NE ' ' OE2' ' A' ' 28' ' ' GLU . 40.9 mtm180 -106.13 113.18 26.56 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.61 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.502 ' SG ' ' OD1' ' A' ' 25' ' ' ASN . 43.7 t -119.16 150.94 39.19 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.245 0.545 . . . . 0.0 110.97 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -122.34 159.83 26.64 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.19 -0.913 . . . . 0.0 110.344 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.5 p -124.05 127.38 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.088 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 99.6 m -105.5 122.84 46.83 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.063 179.601 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.493 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.0 t80 -145.29 136.13 24.56 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 7.0 m 42.26 31.77 0.28 Allowed 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.057 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.83 25.92 61.55 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 120.994 -0.622 . . . . 0.0 111.653 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.493 ' N ' ' O ' ' A' ' 42' ' ' PHE . 85.3 mt-30 -120.44 124.57 45.78 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.724 0.297 . . . . 0.0 110.627 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.5 p -110.41 99.53 8.53 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.307 0.575 . . . . 0.0 111.012 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -100.3 140.6 34.32 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.211 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -145.89 148.95 33.38 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.142 -179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 44.0 t -87.73 161.72 17.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.378 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 79.0 p -91.6 -2.58 57.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.389 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -112.24 133.97 54.05 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.158 0.504 . . . . 0.0 110.532 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.585 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.68 144.65 25.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.648 -179.438 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.62 149.81 38.84 Favored Pre-proline 0 C--N 1.311 -1.092 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.976 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -80.4 -3.06 12.36 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 123.089 2.526 . . . . 0.0 112.666 179.303 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.77 147.69 50.42 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.327 0.584 . . . . 0.0 111.347 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.502 HD23 ' O ' ' A' ' 56' ' ' LEU . 2.1 tt -65.51 -61.51 2.06 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.865 -178.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -56.41 -35.83 68.25 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 120.795 0.331 . . . . 0.0 111.197 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 51.2 m -55.39 -33.35 63.39 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.754 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.31 -41.45 69.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.402 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.432 ' OE2' ' ND2' ' A' ' 25' ' ' ASN . 98.4 mt-10 -65.15 -41.73 94.47 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.92 -179.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.555 ' CG ' ' CG ' ' A' ' 3' ' ' HIS . 37.4 m80 -66.37 -45.62 79.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.052 -179.554 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.01 -36.45 84.44 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.673 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.0 -40.82 86.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.184 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.405 ' O ' HG12 ' A' ' 68' ' ' VAL . . . -68.32 -33.81 74.99 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.824 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -55.22 -46.73 75.95 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.666 0.269 . . . . 0.0 111.173 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.404 HG12 ' H ' ' A' ' 66' ' ' ILE . 21.9 pt -71.85 -38.6 65.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.429 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.44 -49.28 61.03 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.405 HG12 ' O ' ' A' ' 64' ' ' ALA . 8.0 p -62.07 -31.04 50.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.886 0.374 . . . . 0.0 110.053 -179.155 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.88 -27.21 62.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.527 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 35.8 t -68.53 -44.47 74.51 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.82 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 56.8 mt -66.88 -30.04 70.09 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.509 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.432 0 CA-C-O 118.003 -0.999 . . . . 0.0 110.58 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.6 m . . . . . 0 N--CA 1.455 -0.19 0 CA-C-O 120.67 0.272 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -58.33 -44.56 88.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.887 0.375 . . . . 0.0 111.112 -178.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -60.07 -42.91 95.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.009 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.53 -31.84 82.22 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 111.146 -0.781 . . . . 0.0 111.146 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -76.22 -46.92 25.95 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.671 0.272 . . . . 0.0 111.415 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.429 HD23 ' OH ' ' A' ' 23' ' ' TYR . 51.0 tp -62.35 -41.32 98.49 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.435 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -64.74 -43.09 94.46 Favored 'General case' 0 N--CA 1.44 -0.95 0 C-N-CA 119.821 -0.752 . . . . 0.0 110.323 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.51 -39.06 85.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.735 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE2' ' CE1' ' A' ' 16' ' ' HIS . 55.9 t80 -62.45 -52.45 63.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.729 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.69 -49.47 76.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.82 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.7 tp -63.47 -45.24 91.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.831 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -64.71 -39.86 94.37 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.542 -178.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE2' ' A' ' 12' ' ' TYR . 72.9 m80 -86.21 -7.3 58.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.67 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 63.1 t30 62.91 66.0 0.77 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.417 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.9 mt -127.55 148.18 50.34 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.641 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -44.71 137.22 4.02 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 121.07 0.462 . . . . 0.0 109.994 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.6 mt -48.98 144.3 7.64 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.732 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.53 154.7 55.25 Favored 'Trans proline' 0 N--CA 1.495 1.607 0 C-N-CA 122.398 2.065 . . . . 0.0 111.979 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.8 t -130.04 130.63 66.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-O 121.246 0.546 . . . . 0.0 110.792 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.429 ' OH ' HD23 ' A' ' 9' ' ' LEU . 33.8 m-85 -106.9 152.89 23.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.874 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -116.6 143.74 45.24 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.547 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -121.2 124.81 45.6 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 120.691 0.281 . . . . 0.0 111.197 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -134.73 132.79 39.23 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 . . . . . 0 CA--C 1.516 -0.358 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 -179.663 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 85.9 mtt85 . . . . . 0 CA--C 1.516 -0.362 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -114.48 103.34 10.94 Favored 'General case' 0 CA--C 1.501 -0.941 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.112 179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -102.76 107.17 17.95 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.522 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.414 ' O ' ' OE1' ' A' ' 48' ' ' GLN . 69.8 m -113.26 129.82 56.42 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.427 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.421 ' OD1' ' OE1' ' A' ' 48' ' ' GLN . 60.0 m-80 -105.56 150.85 25.01 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.77 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.423 ' O ' HG13 ' A' ' 40' ' ' VAL . 3.0 p -120.36 119.68 60.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 98.5 m -97.32 122.3 40.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.307 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -144.64 135.95 25.31 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.324 -0.398 . . . . 0.0 109.965 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.492 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 43.4 t 47.35 36.3 4.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.925 0.393 . . . . 0.0 110.907 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.454 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 69.56 32.11 71.09 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.332 -0.707 . . . . 0.0 111.332 179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.454 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 98.8 mm-40 -135.17 128.27 31.73 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.731 0.301 . . . . 0.0 110.39 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 55.2 p -107.53 106.83 17.39 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.979 0.419 . . . . 0.0 111.129 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -92.72 141.71 28.16 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.039 179.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.421 ' OE1' ' OD1' ' A' ' 39' ' ' ASN . 69.9 tp60 -152.89 145.55 24.27 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.416 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 92.6 p -86.94 161.2 18.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.412 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.0 p -88.65 -4.05 58.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.895 0.378 . . . . 0.0 110.101 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -112.96 146.62 38.69 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.516 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.68 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -99.96 135.85 40.77 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 121.893 0.854 . . . . 0.0 109.538 -179.97 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.433 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -89.59 150.72 44.83 Favored Pre-proline 0 C--N 1.307 -1.259 0 CA-C-N 114.119 -1.401 . . . . 0.0 110.723 -179.544 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -79.76 -4.57 13.52 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 C-N-CA 122.496 2.13 . . . . 0.0 112.465 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.42 153.44 51.79 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.936 0.398 . . . . 0.0 111.02 -179.145 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.23 -62.82 1.32 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.657 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -55.66 -32.91 63.62 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 120.802 0.334 . . . . 0.0 110.734 -177.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.2 t -56.84 -37.79 71.76 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.829 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.14 -41.71 81.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.057 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -63.5 -44.05 95.48 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.753 0.311 . . . . 0.0 110.841 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 32.7 m-70 -62.06 -48.03 82.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.394 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.52 -36.01 81.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.533 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.65 -48.19 81.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.369 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.68 -33.32 75.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.953 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -54.97 -47.33 74.69 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.614 0.245 . . . . 0.0 111.061 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.4 pt -74.08 -32.21 32.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.5 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.425 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -68.37 -50.29 54.18 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.769 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 p -65.1 -29.98 48.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.743 0.306 . . . . 0.0 110.502 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.24 -33.59 73.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.916 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.425 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 86.1 p . . . . . 0 C--N 1.331 -0.21 0 CA-C-O 120.956 0.408 . . . . 0.0 110.566 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.2 m . . . . . 0 N--CA 1.453 -0.293 0 CA-C-O 120.737 0.303 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -57.91 -44.82 87.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.719 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -58.1 -42.54 85.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.365 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -66.92 -29.74 75.08 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -77.22 -49.3 15.42 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.009 0.433 . . . . 0.0 111.264 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 56.2 tp -62.84 -41.82 99.5 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.445 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -64.7 -40.41 95.32 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 119.538 -0.865 . . . . 0.0 110.611 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.32 -38.32 81.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.557 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -62.13 -49.78 74.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.803 -179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.412 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -57.33 -47.88 80.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.881 0.372 . . . . 0.0 110.39 -179.518 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.2 tp -61.89 -46.2 90.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.615 -179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -65.7 -39.59 91.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.781 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.499 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 60.0 t-80 -88.37 -0.87 57.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.601 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.412 ' N ' ' O ' ' A' ' 13' ' ' ALA . 80.7 m-20 56.17 65.54 1.41 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.671 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 81.7 mt -127.07 148.87 50.13 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.413 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -46.34 134.58 8.79 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.752 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.3 mt -46.91 144.8 3.56 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.692 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.89 153.5 63.72 Favored 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 122.215 1.944 . . . . 0.0 111.878 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 73.6 t -129.83 130.43 66.52 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.339 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -106.37 152.77 23.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.41 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.474 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -117.53 140.54 49.48 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.279 178.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -119.47 125.66 49.44 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.962 0.41 . . . . 0.0 111.319 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -135.0 133.84 39.86 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.061 178.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 69.8 ttp85 . . . . . 0 CA--C 1.518 -0.279 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.172 -179.653 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 91.1 mtm180 . . . . . 0 CA--C 1.516 -0.359 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -113.67 103.55 11.34 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.217 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -99.62 106.33 18.29 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.474 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 45.1 t -112.23 124.42 52.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.489 -179.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -107.77 151.58 25.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.079 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.462 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.0 p -120.59 120.03 61.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.303 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.165 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 87.2 m -96.07 121.42 37.8 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.283 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.556 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 5.0 t80 -142.18 138.99 31.93 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.189 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.556 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 4.0 m 45.25 31.98 0.9 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.743 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 74.88 32.17 57.22 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 42' ' ' PHE . 86.6 mt-30 -136.59 126.76 26.29 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 45.7 p -104.86 106.89 17.58 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.957 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -91.3 140.95 29.3 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.201 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -150.1 150.77 32.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.372 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 29.3 t -91.31 164.38 13.88 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.515 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.8 m -89.41 -7.39 55.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.584 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -117.66 136.9 53.02 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.323 0.582 . . . . 0.0 110.188 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.526 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -90.22 144.13 26.13 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.55 -179.07 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -95.61 148.97 35.44 Favored Pre-proline 0 C--N 1.317 -0.806 0 CA-C-N 114.757 -1.11 . . . . 0.0 111.174 -179.66 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -80.37 -3.81 12.74 Favored 'Trans proline' 0 N--CA 1.494 1.547 0 C-N-CA 122.848 2.365 . . . . 0.0 111.941 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.14 154.02 47.92 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.228 0.537 . . . . 0.0 110.822 -179.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.1 tt -70.25 -64.99 0.78 Allowed 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.475 -178.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -55.19 -35.53 64.92 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 120.98 0.419 . . . . 0.0 110.554 -178.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.3 m -55.32 -34.8 64.51 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.016 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.436 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -70.81 -40.3 72.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.782 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -63.03 -41.25 99.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.331 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -63.76 -49.22 73.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.794 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.57 -35.43 79.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.926 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.94 -48.64 79.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.783 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.47 -33.53 74.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.053 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -54.9 -45.24 74.69 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.685 0.279 . . . . 0.0 111.456 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 22.1 pt -73.27 -33.94 42.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.578 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.59 -50.52 43.81 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.705 -178.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.9 p -63.49 -32.26 56.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.188 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.25 -30.24 68.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.715 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.7 m . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.762 -179.972 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.7 m . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 120.742 0.306 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -56.45 -46.17 80.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.804 -179.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -60.83 -41.98 96.85 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.632 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.85 -33.44 85.79 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -77.74 -49.87 13.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.237 0.541 . . . . 0.0 111.235 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 29.5 tp -62.09 -42.32 99.09 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.169 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -62.85 -41.89 99.54 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.683 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.83 -36.54 80.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.49 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.621 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 83.1 t80 -61.22 -50.61 72.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.816 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.41 -51.53 69.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.904 0.383 . . . . 0.0 110.663 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 51.2 tp -62.85 -44.12 96.99 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.732 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 69.8 tp60 -64.11 -38.49 91.25 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.569 -178.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 68.1 m80 -91.78 -0.46 57.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.718 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 64.7 t30 58.04 66.33 1.13 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.592 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.9 mt -127.93 146.62 50.58 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.017 0.437 . . . . 0.0 110.575 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.512 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 57.0 mp0 -42.62 133.4 3.44 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.103 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.546 ' N ' HD12 ' A' ' 20' ' ' LEU . 10.5 mp -47.2 145.55 3.55 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.691 -178.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.42 153.71 55.6 Favored 'Trans proline' 0 N--CA 1.492 1.441 0 C-N-CA 122.497 2.131 . . . . 0.0 111.881 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 67.3 t -128.85 131.87 67.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.324 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -107.34 152.88 23.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.672 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -115.91 144.47 44.0 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.456 178.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -124.95 123.6 40.23 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.288 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 83.9 mt-10 -133.87 130.72 38.24 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 . . . . . 0 CA--C 1.517 -0.322 0 CA-C-O 120.788 0.328 . . . . 0.0 110.286 -179.538 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 87.5 mtm180 . . . . . 0 CA--C 1.515 -0.392 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -114.22 103.78 11.44 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.036 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -102.34 105.36 15.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.12 0.486 . . . . 0.0 109.731 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 69.0 m -114.08 132.93 55.86 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.452 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -111.41 155.52 23.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.293 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.421 ' O ' HG13 ' A' ' 40' ' ' VAL . 2.9 p -121.11 119.9 60.62 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.301 0 CA-C-O 120.923 0.392 . . . . 0.0 109.95 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 74.8 m -97.33 124.88 41.61 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.681 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -146.08 136.83 24.29 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.125 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.441 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 49.6 t 46.76 32.82 1.88 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.808 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.45 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 74.11 32.85 57.98 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 111.236 -0.745 . . . . 0.0 111.236 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 98.8 mm-40 -136.56 123.62 21.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.804 0.335 . . . . 0.0 110.217 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.2 p -106.13 108.73 20.4 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.115 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -94.5 141.6 28.4 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.007 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -147.86 145.91 28.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.892 0.377 . . . . 0.0 110.422 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.1 p -84.7 163.18 19.36 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.307 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.1 p -90.86 -2.51 57.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.536 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -118.29 154.43 32.3 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.222 0.534 . . . . 0.0 110.105 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.687 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -103.68 134.26 47.31 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.909 -179.405 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.43 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -88.02 147.54 40.99 Favored Pre-proline 0 C--N 1.311 -1.107 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.935 -179.838 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.15 -5.33 16.16 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.759 2.306 . . . . 0.0 112.381 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.429 ' O ' ' OG ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -136.06 155.79 49.69 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.001 0.429 . . . . 0.0 111.107 -179.216 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.97 -64.13 0.92 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.93 -178.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -54.22 -36.17 63.22 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.937 -177.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 55' ' ' THR . 77.8 p -56.05 -33.02 64.58 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.14 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.42 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -71.67 -42.24 67.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.896 0.379 . . . . 0.0 111.128 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -64.21 -42.14 96.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.532 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 43.7 m-70 -66.17 -46.8 76.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.718 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.66 -37.98 83.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.762 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.25 -45.47 94.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.687 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.6 -37.07 77.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.364 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.36 -50.03 75.1 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.356 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 96.6 mt -57.82 -47.78 85.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.216 -178.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.6 -43.88 88.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.008 0.432 . . . . 0.0 110.501 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.2 t -59.48 -41.21 83.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.142 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.08 -29.88 70.78 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.652 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.793 -179.929 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.5 m . . . . . 0 N--CA 1.454 -0.243 0 N-CA-C 110.452 -0.203 . . . . 0.0 110.452 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -60.31 -44.94 94.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.796 0.332 . . . . 0.0 110.815 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -59.1 -41.66 88.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.533 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.6 -28.01 73.44 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -77.64 -49.61 14.18 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.021 0.438 . . . . 0.0 111.018 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.1 tp -61.63 -42.16 98.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.723 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -62.23 -40.14 95.17 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.833 -179.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.28 -38.07 78.18 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.408 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.618 ' CE1' ' CD2' ' A' ' 16' ' ' HIS . 83.9 t80 -62.05 -51.7 66.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.609 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.492 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.81 -49.21 76.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.514 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 51.5 tp -62.41 -44.79 95.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.636 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -65.35 -39.48 92.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.588 -179.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.618 ' CD2' ' CE1' ' A' ' 12' ' ' TYR . 66.5 m-70 -90.28 -5.71 55.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.6 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.492 ' N ' ' O ' ' A' ' 13' ' ' ALA . 64.5 t30 60.72 67.12 0.85 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.559 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 75.7 mt -126.66 148.12 49.86 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.937 0.398 . . . . 0.0 110.584 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.568 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 55.4 mp0 -42.51 131.92 3.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.269 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 pp -46.08 144.57 2.93 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.635 -179.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -72.53 155.42 54.93 Favored 'Trans proline' 0 C--N 1.308 -1.585 0 C-N-CA 122.769 2.313 . . . . 0.0 112.167 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 59.1 t -130.69 132.02 64.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.458 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -108.88 153.54 23.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.765 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -116.16 144.06 44.67 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.817 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -123.61 122.91 39.37 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.937 -179.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -132.39 126.84 34.1 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.735 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 . . . . . 0 C--O 1.235 0.295 0 CA-C-O 120.844 0.354 . . . . 0.0 110.374 -179.507 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 85.0 mtt85 . . . . . 0 CA--C 1.516 -0.36 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -113.65 104.03 11.82 Favored 'General case' 0 C--O 1.217 -0.635 0 C-N-CA 120.479 -0.488 . . . . 0.0 111.335 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -106.21 104.38 14.07 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 81.2 m -113.08 133.53 54.96 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.309 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -111.34 153.98 25.21 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.313 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.442 ' O ' HG13 ' A' ' 40' ' ' VAL . 3.4 p -121.3 119.7 59.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 121.032 0.444 . . . . 0.0 110.159 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 98.0 m -97.07 123.3 40.78 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.788 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -145.26 136.95 25.39 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.325 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.492 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 43.9 t 46.54 36.05 3.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.528 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.433 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 70.56 32.77 67.48 Favored Glycine 0 CA--C 1.52 0.371 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.433 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 98.2 mm-40 -136.25 125.54 24.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.722 0.296 . . . . 0.0 110.342 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.0 p -106.83 107.54 18.61 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.965 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.406 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 54.5 m-85 -92.85 140.94 28.98 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.008 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -147.65 151.08 35.58 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.392 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.6 m -88.74 160.68 17.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.463 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 86.8 p -86.37 -7.74 58.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.548 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -127.64 132.16 49.78 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.412 0.625 . . . . 0.0 110.771 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -80.28 148.75 30.61 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.136 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.556 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -98.1 149.69 35.99 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.875 -179.756 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -75.68 -4.39 15.17 Favored 'Trans proline' 0 C--N 1.311 -1.41 0 C-N-CA 122.764 2.309 . . . . 0.0 112.357 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.445 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -130.54 153.23 49.07 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.235 0.541 . . . . 0.0 110.722 -179.343 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.1 tt -69.7 -66.46 0.59 Allowed 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.293 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -53.41 -36.59 61.65 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.515 -178.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.445 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 79.1 p -54.73 -32.38 59.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.284 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.27 -40.73 70.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.856 0.36 . . . . 0.0 110.813 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -64.91 -38.67 91.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.477 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 22.9 m170 -64.58 -51.77 61.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.81 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.38 -34.33 77.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.645 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.19 -46.76 85.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.639 -179.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.03 -32.71 70.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.651 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -54.18 -45.34 72.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.825 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.8 pt -74.22 -32.87 33.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.068 0.461 . . . . 0.0 110.804 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.18 -50.27 41.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.239 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.6 p -64.36 -31.18 52.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.626 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.42 -28.78 65.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.524 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.406 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 15.6 m . . . . . 0 C--N 1.329 -0.295 0 CA-C-O 121.063 0.458 . . . . 0.0 110.661 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 24.1 m . . . . . 0 N--CA 1.457 -0.095 0 CA-C-O 120.701 0.286 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -59.19 -44.37 92.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.834 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -58.51 -43.09 88.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.258 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.41 -28.27 73.33 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 111.234 -0.746 . . . . 0.0 111.234 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -77.4 -49.58 14.58 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.88 0.372 . . . . 0.0 110.978 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 59.0 tp -63.21 -41.2 99.1 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.323 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -62.49 -41.28 98.69 Favored 'General case' 0 C--N 1.311 -1.101 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.623 -179.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.09 -37.85 81.68 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.934 179.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 80.5 t80 -61.67 -51.22 69.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.775 -179.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.32 -48.5 80.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.434 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.3 tp -62.73 -44.24 96.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.469 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.9 tp60 -65.24 -40.19 93.71 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.601 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 69.1 m80 -89.55 -1.69 58.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.692 -179.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 60.9 t-20 58.59 65.95 1.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.546 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.8 mt -127.4 151.15 49.17 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.583 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -45.58 129.52 8.75 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.722 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.487 HD23 ' H ' ' A' ' 20' ' ' LEU . 0.2 OUTLIER -46.35 146.27 2.4 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.598 -178.876 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.26 152.88 66.97 Favored 'Trans proline' 0 N--CA 1.494 1.501 0 C-N-CA 122.396 2.064 . . . . 0.0 112.041 179.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.1 t -129.83 129.39 66.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.535 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -104.73 152.61 22.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.331 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.458 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -117.93 145.24 44.82 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.526 178.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -121.5 125.62 47.26 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.665 0.269 . . . . 0.0 111.245 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -134.69 123.64 24.02 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 . . . . . 0 CA--C 1.512 -0.501 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 -179.834 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.401 ' NH2' ' CD1' ' A' ' 52' ' ' PHE . 82.8 mtp180 . . . . . 0 CA--C 1.515 -0.379 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -114.96 103.83 11.31 Favored 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 120.161 -0.616 . . . . 0.0 111.296 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.7 mtm180 -101.77 106.36 17.35 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.077 0.465 . . . . 0.0 110.226 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.458 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 42.1 t -109.79 124.5 51.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.375 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -106.63 150.55 26.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.711 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.433 ' O ' HG13 ' A' ' 40' ' ' VAL . 3.4 p -119.28 119.46 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.11 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 94.8 m -94.66 120.19 34.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.212 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.486 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 4.5 t80 -141.36 138.01 32.74 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.203 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.486 ' SG ' ' O ' ' A' ' 42' ' ' PHE . 13.8 p 41.9 44.13 2.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.945 0.402 . . . . 0.0 110.718 179.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 64.64 32.63 84.84 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.443 ' N ' ' O ' ' A' ' 42' ' ' PHE . 47.6 tp60 -137.73 122.51 18.76 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.912 0.387 . . . . 0.0 110.384 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 32.7 p -103.69 109.08 20.64 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.129 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.499 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 15.9 m-85 -89.9 140.74 29.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.859 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -144.95 154.01 42.13 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.341 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.1 m -98.62 159.85 14.67 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.415 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 93.7 p -89.88 -6.88 55.35 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.56 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -116.26 148.88 40.03 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.146 0.498 . . . . 0.0 110.189 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.689 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -101.59 131.26 47.88 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-N 115.228 -0.897 . . . . 0.0 109.822 -179.331 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.462 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -85.98 148.84 49.06 Favored Pre-proline 0 C--N 1.307 -1.247 0 CA-C-N 114.142 -1.39 . . . . 0.0 110.688 -179.566 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -77.42 -5.17 15.39 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 122.395 2.064 . . . . 0.0 112.563 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.4 HG22 ' N ' ' A' ' 56' ' ' LEU . 48.7 m -135.43 153.09 51.9 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.255 0.55 . . . . 0.0 111.179 -179.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.4 ' N ' HG22 ' A' ' 55' ' ' THR . 0.5 OUTLIER -64.7 -62.56 1.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.554 -178.782 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.47 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 69.0 mttm -55.07 -33.63 62.91 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 120.992 0.425 . . . . 0.0 110.601 -177.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.4 t -56.46 -36.93 69.62 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.003 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.87 -41.62 74.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.7 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -61.13 -40.81 95.2 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.42 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.603 ' ND1' ' N ' ' A' ' 61' ' ' HIS . 0.4 OUTLIER -67.5 -44.87 77.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.656 -179.525 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.92 -40.85 87.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.074 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.77 -50.68 72.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.682 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.459 ' O ' HG12 ' A' ' 68' ' ' VAL . . . -61.33 -37.73 84.34 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.351 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -55.81 -45.89 78.17 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.881 0.372 . . . . 0.0 110.324 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.62 -43.82 93.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.862 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.24 -49.56 64.01 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -178.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 64' ' ' ALA . 8.4 p -65.05 -31.77 55.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.175 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.95 -27.56 65.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.633 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 59.7 p . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.599 179.93 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 32.7 m . . . . . 0 N--CA 1.452 -0.354 0 CA-C-O 120.574 0.226 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -55.77 -43.74 77.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.828 0.346 . . . . 0.0 110.923 -178.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -59.88 -42.59 94.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.437 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -74.55 -26.32 67.95 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.66 -0.576 . . . . 0.0 111.66 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -77.17 -49.02 16.1 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.655 0.264 . . . . 0.0 111.506 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.6 tp -63.58 -41.37 98.38 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.179 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -65.12 -42.13 94.22 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.257 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.14 -37.57 84.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.667 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 92.4 t80 -61.5 -48.93 78.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.657 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.441 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.82 -45.83 82.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.798 0.332 . . . . 0.0 110.521 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.3 tp -62.86 -46.17 89.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.729 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -66.04 -42.68 89.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.966 0.413 . . . . 0.0 110.627 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.481 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 66.9 t-80 -84.8 -5.43 59.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.831 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.441 ' N ' ' O ' ' A' ' 13' ' ' ALA . 61.7 t-20 58.66 65.46 1.24 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.716 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.407 HD21 ' ND1' ' A' ' 16' ' ' HIS . 80.5 mt -123.38 148.37 46.14 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.683 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -41.72 152.64 0.07 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.302 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.445 ' CD2' ' N ' ' A' ' 20' ' ' LEU . 3.6 mm? -61.61 139.43 95.18 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.468 -178.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -72.07 152.89 57.32 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 122.362 2.042 . . . . 0.0 112.013 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 72.2 t -131.45 130.96 63.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.935 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -107.28 152.22 24.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.422 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.442 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -115.94 141.53 47.99 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 115.602 -0.727 . . . . 0.0 109.133 178.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -119.8 125.14 47.84 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.751 0.31 . . . . 0.0 111.353 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -134.01 128.69 34.87 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 . . . . . 0 CA--C 1.512 -0.482 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -179.533 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 . . . . . 0 N--CA 1.464 0.251 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -114.54 103.07 10.65 Favored 'General case' 0 CA--C 1.498 -1.029 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.963 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.9 mmm-85 -101.31 107.41 18.76 Favored 'General case' 0 C--N 1.316 -0.856 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.386 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 43.7 t -111.85 126.21 54.85 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.787 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -106.36 152.98 22.87 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 p -121.14 120.4 62.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.279 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 52.1 m -98.22 120.44 38.64 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.913 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.497 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 6.3 t80 -144.06 137.35 27.53 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.264 -0.425 . . . . 0.0 109.988 -179.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.497 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 7.6 m 47.46 40.04 10.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.832 0.349 . . . . 0.0 110.754 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 66.02 31.72 80.31 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 111.598 -0.601 . . . . 0.0 111.598 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -135.83 126.01 26.31 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.746 0.307 . . . . 0.0 110.355 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 27.6 m -107.51 108.83 20.32 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.877 0.37 . . . . 0.0 110.852 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -93.31 141.92 27.9 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.744 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -142.94 144.23 32.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.593 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.5 p -84.11 162.19 20.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.634 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.7 p -93.3 -7.53 44.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.225 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -116.96 152.58 34.27 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.364 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.699 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -103.73 132.48 49.94 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.85 0.833 . . . . 0.0 109.735 -179.671 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.406 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -87.48 149.42 46.58 Favored Pre-proline 0 C--N 1.303 -1.423 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.454 -179.855 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.12 -5.1 14.91 Favored 'Trans proline' 0 N--CA 1.494 1.515 0 C-N-CA 122.588 2.192 . . . . 0.0 112.704 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 51.6 m -135.09 150.95 50.32 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.875 0.369 . . . . 0.0 111.201 -178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.31 -61.73 2.16 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.734 -178.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.523 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 68.8 mttm -54.95 -34.44 63.27 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 120.792 0.33 . . . . 0.0 110.91 -178.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.2 t -55.57 -38.42 69.33 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.066 0.46 . . . . 0.0 109.849 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.59 -41.68 79.28 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.345 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -64.12 -43.67 94.58 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.764 0.316 . . . . 0.0 110.821 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.523 ' CD2' ' O ' ' A' ' 57' ' ' LYS . 84.8 m-70 -67.38 -45.61 75.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.674 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.0 -40.37 87.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.2 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.01 -45.37 93.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.839 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.41 ' O ' HG23 ' A' ' 68' ' ' VAL . . . -58.95 -38.19 78.48 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.527 -179.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -57.83 -48.45 79.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.789 179.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.6 mt -57.87 -48.88 82.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.166 -178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.03 -43.47 92.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.639 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 64' ' ' ALA . 20.8 t -59.14 -42.58 87.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 109.994 -179.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.99 -29.86 71.15 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.929 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.8 t . . . . . 0 CA--C 1.53 0.192 0 CA-C-O 120.876 0.369 . . . . 0.0 111.285 179.767 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.9 m . . . . . 0 N--CA 1.455 -0.215 0 CA-C-O 120.61 0.243 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -61.43 -42.79 99.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.8 0.334 . . . . 0.0 111.063 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -59.33 -39.6 83.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.412 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.28 -24.34 59.36 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -77.28 -50.1 13.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.149 0.5 . . . . 0.0 110.859 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.5 tp -63.27 -41.79 99.06 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.328 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.0 tp-100 -60.79 -41.3 95.3 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 120.086 -0.645 . . . . 0.0 110.803 -178.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.67 -37.3 86.12 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.426 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 81.0 t80 -61.35 -49.87 75.21 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.898 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.488 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.96 -49.39 75.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.953 0.406 . . . . 0.0 110.293 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.2 tp -62.78 -44.25 96.66 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.581 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -64.17 -37.32 87.05 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.698 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 59.3 m80 -94.83 -2.36 50.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.7 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 13' ' ' ALA . 55.2 t-20 59.29 66.57 1.01 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.715 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 71.5 mt -124.49 149.96 46.29 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.459 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -46.06 134.58 8.16 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.906 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.49 HD23 ' H ' ' A' ' 20' ' ' LEU . 0.2 OUTLIER -46.91 146.73 2.57 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.745 -178.844 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.36 154.66 45.93 Favored 'Trans proline' 0 N--CA 1.496 1.631 0 C-N-CA 122.758 2.306 . . . . 0.0 112.354 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.0 t -129.9 130.38 66.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.379 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -107.42 152.34 24.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.857 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.438 ' HB3' ' CG ' ' A' ' 39' ' ' ASN . . . -119.68 134.87 55.06 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -115.59 125.68 53.25 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.983 0.42 . . . . 0.0 111.516 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -129.83 127.75 40.91 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.515 178.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 . . . . . 0 CA--C 1.515 -0.371 0 CA-C-O 120.657 0.265 . . . . 0.0 110.314 -179.546 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 87.5 mtm180 . . . . . 0 CA--C 1.514 -0.408 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -113.78 104.13 11.9 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.461 -0.496 . . . . 0.0 111.144 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.584 ' NH2' ' NE2' ' A' ' 48' ' ' GLN . 81.1 mtp85 -106.34 105.46 15.5 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.1 m -119.15 144.0 46.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.067 0.461 . . . . 0.0 110.203 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.438 ' CG ' ' HB3' ' A' ' 24' ' ' ALA . 13.6 p30 -124.3 160.1 28.78 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.452 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.427 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.1 p -120.28 120.69 63.63 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.253 0 CA-C-O 121.119 0.485 . . . . 0.0 110.202 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.407 ' OG1' HG22 ' A' ' 46' ' ' THR . 66.7 m -95.9 116.96 29.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.152 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -139.34 137.36 35.71 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.97 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.497 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 43.1 t 48.04 32.3 2.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.814 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.86 33.52 57.5 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -137.87 122.86 19.03 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.407 HG22 ' OG1' ' A' ' 41' ' ' THR . 18.7 p -105.02 109.56 21.61 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.05 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -95.12 141.42 28.77 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.084 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.584 ' NE2' ' NH2' ' A' ' 37' ' ' ARG . 58.0 tt0 -148.31 144.51 27.63 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.856 0.36 . . . . 0.0 110.546 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.3 p -84.3 163.13 19.81 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.631 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.0 m -89.76 -7.34 54.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.648 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -112.28 148.94 33.11 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.128 0.49 . . . . 0.0 109.929 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.685 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -101.61 131.95 47.54 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.481 -179.615 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.503 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -86.43 148.29 46.45 Favored Pre-proline 0 C--N 1.307 -1.257 0 CA-C-N 114.076 -1.42 . . . . 0.0 111.131 -179.489 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -77.42 -8.38 17.25 Favored 'Trans proline' 0 N--CA 1.495 1.584 0 C-N-CA 122.674 2.25 . . . . 0.0 111.984 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 41.5 m -129.07 148.4 51.02 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.772 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 56' ' ' LEU . 1.4 tt -63.83 -61.9 1.99 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.159 -178.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -54.49 -34.21 61.21 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 121.028 -0.269 . . . . 0.0 110.741 -178.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.5 t -55.89 -34.03 65.17 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.104 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.87 -41.98 67.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.158 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -63.99 -41.68 97.43 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.663 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -66.99 -47.76 70.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.811 0.339 . . . . 0.0 110.83 -179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.51 -38.29 84.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.606 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.8 -48.37 82.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.597 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.06 -36.81 80.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.366 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.0 -47.43 83.05 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 97.1 mt -59.69 -45.92 93.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.106 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.32 -43.29 86.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.087 0.47 . . . . 0.0 110.41 179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.1 t -59.56 -42.3 87.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.216 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.05 -27.45 69.11 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.969 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.4 t . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.557 -179.896 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 N--CA 1.455 -0.223 0 CA-C-O 120.58 0.229 . . . . 0.0 110.936 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.639 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 4.7 m-85 -58.14 -42.97 87.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.862 -178.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.412 ' NZ ' ' OE1' ' A' ' 60' ' ' GLU . 98.8 mttt -59.45 -40.37 86.62 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.213 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -69.99 -28.15 72.13 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.202 -0.759 . . . . 0.0 111.202 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -77.28 -50.68 12.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.103 0.478 . . . . 0.0 111.357 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 56.1 tp -62.38 -41.51 98.7 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.259 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -62.53 -39.62 94.16 Favored 'General case' 0 C--N 1.31 -1.134 0 C-N-CA 119.641 -0.824 . . . . 0.0 110.035 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.42 -39.39 77.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.82 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -61.78 -52.61 63.52 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.031 -179.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.87 -47.86 79.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.021 0.439 . . . . 0.0 110.304 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.8 tp -62.56 -44.41 96.39 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.593 -179.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -65.03 -40.89 95.49 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.597 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.525 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 64.8 t-80 -87.03 -2.8 58.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.77 -179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 58.72 65.56 1.22 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.888 0.375 . . . . 0.0 110.185 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.8 mt -128.67 147.43 50.74 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.498 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -41.7 133.41 2.73 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.568 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.5 mt -48.13 144.39 5.99 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.96 -179.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -70.6 153.94 64.74 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.317 2.012 . . . . 0.0 111.952 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.5 t -131.43 130.54 62.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.636 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -105.22 153.11 22.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.447 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.475 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -119.57 140.81 49.96 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.371 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -118.05 126.69 52.77 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.787 0.327 . . . . 0.0 111.205 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -136.5 131.16 33.59 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 178.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.9 ttp85 . . . . . 0 CA--C 1.515 -0.381 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.649 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.609 ' NH1' ' CD1' ' A' ' 52' ' ' PHE . 96.5 mtt-85 . . . . . 0 CA--C 1.517 -0.295 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -114.36 103.96 11.59 Favored 'General case' 0 CA--C 1.508 -0.639 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.85 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -99.97 106.61 18.43 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.646 -0.422 . . . . 0.0 109.909 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.475 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 45.9 t -111.02 123.05 49.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.505 -179.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -106.47 150.55 25.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.002 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.483 ' O ' HG13 ' A' ' 40' ' ' VAL . 5.5 p -119.76 119.74 61.23 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.201 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 96.5 m -93.96 122.12 36.14 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.375 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -143.0 131.99 22.94 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.473 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 49.9 t 46.14 46.7 13.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.933 0.397 . . . . 0.0 110.81 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.09 33.2 84.97 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.281 -0.727 . . . . 0.0 111.281 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.423 ' CG ' ' CE1' ' A' ' 47' ' ' PHE . 68.1 tp60 -139.28 125.17 19.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.826 0.346 . . . . 0.0 110.203 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.8 p -105.41 109.95 22.11 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.233 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.423 ' CE1' ' CG ' ' A' ' 45' ' ' GLN . 51.4 m-85 -90.77 140.88 29.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.165 -0.47 . . . . 0.0 109.782 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -148.51 149.4 31.58 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.175 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 42.5 t -88.69 162.12 16.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.642 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 96.4 p -87.67 -6.8 58.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.716 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -123.1 143.45 49.97 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.211 0.529 . . . . 0.0 110.781 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.609 ' CD1' ' NH1' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -91.7 142.62 27.41 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.891 -179.272 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.501 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -94.22 147.59 33.63 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 114.659 -1.155 . . . . 0.0 111.185 -179.568 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -76.15 -4.71 15.45 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 C-N-CA 122.69 2.26 . . . . 0.0 112.496 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.33 155.37 50.71 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.225 0.536 . . . . 0.0 111.132 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.03 -64.04 0.94 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.371 -178.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -54.64 -34.23 61.82 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 120.659 0.266 . . . . 0.0 110.575 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.6 t -55.79 -36.44 67.39 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.573 -0.451 . . . . 0.0 109.803 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.482 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -70.84 -41.19 71.79 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.5 -179.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.412 ' OE1' ' NZ ' ' A' ' 6' ' ' LYS . 98.7 mt-10 -62.15 -43.06 99.68 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.874 -179.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.639 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -62.7 -51.38 67.41 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.208 0.528 . . . . 0.0 110.311 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.57 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -64.84 -35.24 80.47 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.176 -178.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.79 -49.39 77.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.594 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.7 -32.52 71.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.612 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -55.22 -45.75 75.96 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.619 0.247 . . . . 0.0 111.151 -179.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.3 pt -72.12 -37.45 59.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.62 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.85 -50.44 56.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.001 0.429 . . . . 0.0 111.961 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.96 -36.81 78.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.67 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.61 -26.96 68.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.755 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 37.5 m . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.936 179.743 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.1 m . . . . . 0 CA--C 1.522 -0.121 0 CA-C-O 120.618 0.247 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -60.13 -42.17 94.22 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.826 0.346 . . . . 0.0 110.867 -178.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.649 ' HZ3' ' CD2' ' A' ' 61' ' ' HIS . 64.3 mttp -60.87 -41.25 95.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.211 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.37 -31.62 81.47 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.736 -0.946 . . . . 0.0 110.736 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -75.94 -48.53 20.84 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.709 0.29 . . . . 0.0 111.459 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.431 HD23 ' OH ' ' A' ' 23' ' ' TYR . 48.2 tp -62.99 -39.42 94.66 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.305 -179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -63.06 -41.66 99.5 Favored 'General case' 0 N--CA 1.437 -1.105 0 C-N-CA 119.655 -0.818 . . . . 0.0 110.285 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.64 -40.25 84.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.895 179.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.42 ' O ' ' N ' ' A' ' 16' ' ' HIS . 53.8 t80 -61.98 -51.28 68.69 Favored 'General case' 0 N--CA 1.462 0.148 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.805 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.98 -40.4 73.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.433 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 39.1 tp -63.17 -46.21 88.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.529 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -79.61 -20.52 46.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.975 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.42 ' N ' ' O ' ' A' ' 12' ' ' TYR . 38.8 t-80 -87.15 -13.55 43.74 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.693 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 49.62 64.88 1.58 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.249 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.551 HD21 ' CZ ' ' A' ' 42' ' ' PHE . 0.9 OUTLIER -139.79 169.16 18.22 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.982 0.42 . . . . 0.0 110.452 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -46.36 126.08 7.54 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.739 178.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.539 HD23 ' H ' ' A' ' 20' ' ' LEU . 0.2 OUTLIER -45.81 151.42 0.85 Allowed Pre-proline 0 CA--C 1.539 0.542 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.669 -178.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.18 151.03 72.39 Favored 'Trans proline' 0 N--CA 1.499 1.802 0 C-N-CA 122.42 2.08 . . . . 0.0 112.215 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.4 t -133.51 131.08 57.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.227 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.431 ' OH ' HD23 ' A' ' 9' ' ' LEU . 32.2 m-85 -106.14 152.13 23.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.885 179.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.43 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -114.56 146.01 41.27 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.1 178.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -124.42 124.56 42.6 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.788 0.328 . . . . 0.0 111.636 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -132.75 129.07 38.16 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 71.2 ttt-85 . . . . . 0 CA--C 1.516 -0.359 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.355 -179.528 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 . . . . . 0 N--CA 1.464 0.267 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -114.56 102.39 10.01 Favored 'General case' 0 CA--C 1.505 -0.787 0 C-N-CA 119.647 -0.821 . . . . 0.0 111.53 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.5 mtp85 -101.08 107.82 19.35 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.789 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.43 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 48.4 t -109.53 122.35 47.24 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.634 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.508 ' OD1' ' N ' ' A' ' 40' ' ' VAL . 40.8 t-20 -103.61 150.74 23.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.701 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.508 ' N ' ' OD1' ' A' ' 39' ' ' ASN . 4.0 p -122.42 119.6 58.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.866 0.365 . . . . 0.0 110.417 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 98.3 m -96.47 121.33 38.16 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.072 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.551 ' CZ ' HD21 ' A' ' 18' ' ' LEU . 6.1 t80 -144.19 136.0 26.09 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.422 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 42.7 t 45.82 44.65 11.07 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.411 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.54 30.76 77.48 Favored Glycine 0 CA--C 1.526 0.776 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.921 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -135.48 131.06 35.64 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 122.691 -0.299 . . . . 0.0 110.314 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 54.4 p -108.8 107.4 17.81 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.047 0.451 . . . . 0.0 111.101 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -92.7 141.56 28.34 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.111 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -152.23 147.7 26.7 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.749 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.4 p -85.79 166.14 16.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.818 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 85.3 p -92.64 -6.96 48.28 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.626 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -122.7 129.51 51.89 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.006 0.432 . . . . 0.0 110.898 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -79.2 148.64 32.19 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.686 0.755 . . . . 0.0 110.17 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.485 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -96.22 150.33 37.05 Favored Pre-proline 0 C--N 1.313 -0.982 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.857 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -77.6 -4.41 14.57 Favored 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 122.421 2.081 . . . . 0.0 112.712 178.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.8 152.42 51.74 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 120.961 0.41 . . . . 0.0 110.851 -179.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.43 -62.44 1.53 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.762 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -56.11 -35.97 67.68 Favored 'General case' 0 CA--C 1.52 -0.198 0 O-C-N 122.137 -0.352 . . . . 0.0 110.816 -177.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 38.5 m -54.68 -36.12 64.3 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.451 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -69.1 -43.21 74.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.454 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.54 -41.86 97.97 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.463 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.649 ' CD2' ' HZ3' ' A' ' 6' ' ' LYS . 32.4 m170 -62.73 -48.81 77.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.766 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.05 -35.51 80.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.827 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.47 -48.88 79.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.478 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.86 -33.49 75.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -54.79 -46.91 74.51 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.656 0.265 . . . . 0.0 111.084 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.1 pt -73.97 -33.11 35.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.872 0.368 . . . . 0.0 110.663 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.435 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -67.33 -50.26 60.76 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.831 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.3 p -65.4 -30.11 49.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.527 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.41 -33.86 73.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.118 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.435 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 78.0 p . . . . . 0 C--N 1.331 -0.216 0 CA-C-O 121.019 0.438 . . . . 0.0 110.576 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.531 0.245 0 CA-C-O 120.966 0.412 . . . . 0.0 110.635 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.628 ' N ' ' CD1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -61.17 -23.83 65.85 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.859 -179.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -62.39 -42.39 99.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.154 0.502 . . . . 0.0 110.322 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.72 -23.55 76.44 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.086 -0.806 . . . . 0.0 111.086 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -78.04 -50.35 12.25 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.83 0.348 . . . . 0.0 111.179 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.5 tp -62.74 -42.59 99.74 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.14 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.9 tp-100 -64.45 -42.58 95.88 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.138 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.91 -37.27 78.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.824 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -61.52 -49.83 75.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.679 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.473 ' HB2' ' HZ ' ' A' ' 42' ' ' PHE . . . -58.6 -47.3 84.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.934 0.397 . . . . 0.0 110.246 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.4 tp -62.15 -46.37 89.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.517 -179.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -65.76 -38.7 89.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.976 0.417 . . . . 0.0 110.487 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.502 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 61.6 t-80 -87.51 -0.58 57.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.607 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 56.5 65.1 1.5 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.642 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 81.6 mt -127.71 151.7 48.65 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.678 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -46.86 128.0 10.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.131 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.573 ' N ' HD12 ' A' ' 20' ' ' LEU . 10.0 mp -46.95 147.95 2.08 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.473 -178.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.06 152.57 62.7 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.369 2.046 . . . . 0.0 112.214 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 68.7 t -130.22 130.2 65.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.517 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -105.37 152.62 22.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.596 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.494 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -116.56 145.1 43.6 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.476 178.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -123.29 124.62 43.39 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.837 0.351 . . . . 0.0 111.234 -179.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -134.14 134.75 42.55 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.805 178.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 . . . . . 0 N--CA 1.465 0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.687 -179.36 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 . . . . . 0 CA--C 1.515 -0.402 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -114.86 104.35 11.85 Favored 'General case' 0 CA--C 1.506 -0.737 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.789 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -101.76 107.25 18.4 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.065 0.46 . . . . 0.0 110.599 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.494 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 50.9 t -109.55 124.25 50.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.967 -179.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -105.24 149.95 25.55 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.476 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.3 p -119.7 119.32 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 120.913 0.387 . . . . 0.0 110.025 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 96.4 m -95.67 121.93 37.9 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.12 179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.482 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 5.3 t80 -143.07 137.38 29.15 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.36 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.483 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 12.0 p 42.19 42.83 2.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.829 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.484 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 66.16 32.35 82.01 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.436 -0.666 . . . . 0.0 111.436 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.484 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 97.7 mm-40 -136.46 130.87 33.25 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.66 0.266 . . . . 0.0 110.357 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 61.8 p -110.04 107.59 17.51 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.221 -179.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.427 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 52.3 m-85 -94.14 141.06 28.97 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.966 179.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -154.26 148.03 25.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.481 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.6 p -85.31 168.21 14.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.464 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.9 p -93.83 -0.61 55.71 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.544 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -120.88 153.28 37.38 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.044 0.449 . . . . 0.0 110.344 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.686 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -103.94 134.69 46.81 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.813 -179.488 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.49 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -86.27 147.99 46.17 Favored Pre-proline 0 C--N 1.306 -1.318 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.579 -179.695 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.41 -4.63 15.28 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.704 2.269 . . . . 0.0 112.433 179.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -136.09 154.73 50.92 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.079 0.466 . . . . 0.0 111.22 -179.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.17 -62.62 1.43 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.312 -178.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.41 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 98.8 mttt -55.39 -34.46 64.37 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.756 0.312 . . . . 0.0 110.658 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 39.4 m -54.48 -35.94 63.61 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.454 -0.498 . . . . 0.0 109.925 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.477 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -72.17 -43.71 64.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.408 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -63.76 -44.27 93.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.645 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.41 ' CD2' ' O ' ' A' ' 57' ' ' LYS . 89.3 m-70 -64.04 -49.19 73.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.627 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.93 -35.2 79.96 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.611 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.15 -41.43 83.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.261 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.28 -34.59 78.34 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.625 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -53.87 -47.58 70.91 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.508 0.194 . . . . 0.0 110.907 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.403 HG12 ' H ' ' A' ' 66' ' ' ILE . 25.8 pt -74.35 -27.93 22.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.583 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.58 -51.15 30.3 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.914 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.0 p -63.27 -30.67 50.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.425 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.9 -35.1 76.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.862 0.363 . . . . 0.0 110.794 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.427 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 17.7 m . . . . . 0 C--N 1.331 -0.232 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.668 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 33.2 m . . . . . 0 N--CA 1.452 -0.371 0 CA-C-O 120.593 0.235 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.66 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 3.2 m-85 -59.31 -44.21 92.58 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.759 -178.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -58.45 -43.53 88.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.413 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -72.79 -24.38 76.18 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 69.7 tp60 -77.13 -48.77 16.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.946 0.403 . . . . 0.0 111.087 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.4 HD23 ' OH ' ' A' ' 23' ' ' TYR . 58.8 tp -61.75 -41.45 97.7 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.291 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -62.85 -40.82 98.64 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.743 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.98 -38.18 79.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.553 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 86.0 t80 -62.0 -51.75 66.78 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.665 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.511 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -58.19 -46.22 86.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.416 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.6 tp -62.26 -47.2 85.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.729 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -66.19 -36.44 83.1 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.627 -179.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 61.8 m80 -92.05 -3.2 56.09 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.711 -179.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.511 ' N ' ' O ' ' A' ' 13' ' ' ALA . 97.4 m-20 56.76 66.01 1.27 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.698 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 70.1 mt -125.31 145.39 50.04 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.988 0.423 . . . . 0.0 110.48 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.644 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 1.3 pm0 -41.04 134.96 1.89 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.183 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.8 mt -47.31 143.37 5.17 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.973 -179.006 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -73.06 153.41 52.07 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 122.37 2.047 . . . . 0.0 111.989 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.4 t -129.65 130.62 66.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.413 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.4 ' OH ' HD23 ' A' ' 9' ' ' LEU . 33.6 m-85 -107.02 153.01 23.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.718 179.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.504 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -115.47 146.39 41.7 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.326 178.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -123.97 124.16 41.98 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.062 0.458 . . . . 0.0 111.357 -179.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -134.86 129.34 34.27 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.0 ttt-85 . . . . . 0 CA--C 1.519 -0.248 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.532 -179.419 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 84.8 mtm-85 . . . . . 0 CA--C 1.516 -0.336 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -114.23 104.05 11.7 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.949 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -102.87 105.84 16.3 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.504 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 52.6 t -109.21 124.55 51.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.398 -179.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -105.43 150.02 25.64 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.919 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.463 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.1 p -120.9 119.69 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 CA-C-O 121.036 0.446 . . . . 0.0 110.243 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 96.4 m -97.23 120.48 37.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.506 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.556 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 5.1 t80 -141.68 137.8 32.01 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.266 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.556 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 3.9 m 45.32 37.32 2.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.716 179.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.471 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 69.68 32.62 70.84 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 111.25 -0.74 . . . . 0.0 111.25 179.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.471 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 98.0 mm-40 -135.99 125.11 24.44 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 39.9 p -105.78 107.33 18.27 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.105 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -92.5 141.07 28.92 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.019 179.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 55.1 tt0 -150.49 152.3 34.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.325 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 73.2 m -95.42 160.56 14.47 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.532 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.8 m -87.2 -7.1 58.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.713 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.537 ' N ' ' OE1' ' A' ' 51' ' ' GLU . 56.3 mp0 -115.26 151.86 33.75 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.271 0.558 . . . . 0.0 110.237 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.691 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -103.53 133.7 48.12 Favored 'General case' 0 CA--C 1.505 -0.75 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.01 -179.219 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.46 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -86.19 147.16 44.28 Favored Pre-proline 0 C--N 1.308 -1.236 0 CA-C-N 114.118 -1.401 . . . . 0.0 110.831 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.84 -5.13 16.08 Favored 'Trans proline' 0 N--CA 1.498 1.756 0 C-N-CA 122.792 2.328 . . . . 0.0 112.581 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.07 155.42 50.77 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.141 0.496 . . . . 0.0 111.002 -179.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.68 -64.68 0.81 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.569 -178.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -53.11 -33.45 52.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.894 0.378 . . . . 0.0 110.657 -178.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.2 m -57.26 -35.05 69.26 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.047 179.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.3 -41.22 70.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.27 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -62.31 -40.25 95.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.38 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.66 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -64.66 -51.17 63.95 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.204 0.526 . . . . 0.0 110.501 179.74 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.549 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -65.71 -35.73 81.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.595 -178.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.91 -48.91 79.78 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.492 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.36 -32.91 73.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.733 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -54.93 -45.86 74.88 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.851 0.357 . . . . 0.0 111.34 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.2 pt -73.74 -33.51 38.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.986 0.422 . . . . 0.0 110.548 179.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.83 -50.0 47.02 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.125 0.488 . . . . 0.0 111.64 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.2 p -64.56 -31.11 52.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.407 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.51 -30.2 68.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.722 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.1 t . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.805 179.823 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.4 m . . . . . 0 N--CA 1.452 -0.361 0 CA-C-O 120.619 0.247 . . . . 0.0 110.399 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -58.45 -44.15 89.12 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 120.805 0.336 . . . . 0.0 110.722 -179.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -58.98 -37.05 75.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.527 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.52 -26.26 59.47 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.1 mm-40 -78.66 -50.77 10.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.985 0.421 . . . . 0.0 111.091 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 35.7 tp -61.44 -42.78 99.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.582 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -63.15 -40.67 98.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.814 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.86 -37.35 79.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.385 179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -61.74 -50.01 74.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.769 -179.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.467 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.91 -47.71 79.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.942 0.401 . . . . 0.0 110.584 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.3 tp -61.6 -45.4 94.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.548 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -66.2 -41.81 89.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.649 -179.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.474 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 66.3 t-80 -86.52 -5.05 59.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.565 -179.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.467 ' N ' ' O ' ' A' ' 13' ' ' ALA . 44.4 t-20 60.49 65.83 1.01 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.584 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.7 mt -125.34 147.83 48.98 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.868 0.366 . . . . 0.0 110.393 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -45.41 134.37 6.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.033 0.444 . . . . 0.0 110.272 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.5 mt -46.06 143.85 3.27 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.739 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -73.0 155.44 52.8 Favored 'Trans proline' 0 C--N 1.309 -1.531 0 C-N-CA 122.733 2.289 . . . . 0.0 112.086 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.4 t -129.53 132.38 66.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.466 179.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -108.88 153.59 23.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.692 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.51 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -116.19 141.17 48.49 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.823 178.322 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -119.76 125.53 48.84 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.026 0.441 . . . . 0.0 110.966 -179.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -135.09 125.86 27.26 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.769 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 . . . . . 0 C--O 1.233 0.215 0 CA-C-O 120.954 0.407 . . . . 0.0 110.388 -179.457 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 . . . . . 0 CA--C 1.516 -0.362 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -114.11 103.89 11.57 Favored 'General case' 0 C--O 1.216 -0.706 0 C-N-CA 120.338 -0.545 . . . . 0.0 111.162 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.669 HH21 ' NE2' ' A' ' 48' ' ' GLN . 79.5 mtp85 -104.94 104.95 14.8 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.51 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 53.7 t -110.08 128.3 55.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.42 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -108.29 152.36 24.73 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.128 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.4 HG13 ' O ' ' A' ' 40' ' ' VAL . 2.7 p -121.06 120.46 62.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.074 0.464 . . . . 0.0 110.285 -179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 54.1 m -98.85 119.31 37.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.554 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -143.05 136.24 28.17 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.369 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.47 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 42.6 t 52.21 33.63 12.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.607 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 70.33 33.9 68.66 Favored Glycine 0 CA--C 1.522 0.488 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -139.09 125.4 20.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.836 0.35 . . . . 0.0 110.338 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 33.1 m -105.48 109.79 21.89 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.046 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -95.54 141.15 29.4 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.847 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.669 ' NE2' HH21 ' A' ' 37' ' ' ARG . 58.9 tt0 -144.58 147.96 33.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.933 0.397 . . . . 0.0 110.42 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.423 ' OG ' ' O ' ' A' ' 51' ' ' GLU . 9.3 p -84.63 161.83 19.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.523 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 91.5 p -88.61 -6.75 57.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.554 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.423 ' O ' ' OG ' ' A' ' 49' ' ' SER . 98.8 mt-10 -122.5 157.05 32.85 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.083 0.468 . . . . 0.0 110.355 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.69 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -105.01 139.22 40.02 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.613 0.721 . . . . 0.0 110.036 -179.271 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.466 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -91.4 147.77 36.12 Favored Pre-proline 0 C--N 1.308 -1.198 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.75 -179.668 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.81 -5.3 16.27 Favored 'Trans proline' 0 C--N 1.312 -1.388 0 C-N-CA 122.838 2.359 . . . . 0.0 112.4 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.447 HG22 ' N ' ' A' ' 56' ' ' LEU . 44.1 m -132.61 155.78 48.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.266 0.555 . . . . 0.0 110.729 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.447 ' N ' HG22 ' A' ' 55' ' ' THR . 0.9 OUTLIER -69.86 -64.92 0.79 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.122 -178.676 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -52.02 -37.26 52.78 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.587 -177.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.433 ' OG ' ' O ' ' A' ' 55' ' ' THR . 78.0 p -55.0 -33.08 62.29 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 123.429 0.455 . . . . 0.0 110.382 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.47 -40.9 66.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.823 0.344 . . . . 0.0 110.925 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -64.47 -40.4 95.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.383 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -68.17 -46.08 71.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.752 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.92 -39.64 83.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.848 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.19 -48.95 79.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.728 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.32 -36.79 78.73 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.404 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -58.06 -47.7 82.36 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 86.3 mt -58.15 -47.32 87.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.318 -179.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.76 -44.94 76.31 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.587 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.5 t -58.54 -42.5 84.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.048 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.99 -25.97 68.37 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.539 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 6.3 t . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.633 -179.971 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.6 m . . . . . 0 N--CA 1.453 -0.283 0 CA-C-O 120.489 0.185 . . . . 0.0 110.895 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.651 ' CE2' ' ND1' ' A' ' 61' ' ' HIS . 17.6 m-85 -43.12 -64.79 0.57 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.88 0.371 . . . . 0.0 111.243 -179.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -50.83 -36.57 38.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.577 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -66.62 -36.69 91.72 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.916 -0.873 . . . . 0.0 110.916 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.8 tp60 -77.85 -49.2 14.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.988 0.423 . . . . 0.0 111.241 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 39.1 tp -60.06 -41.96 93.46 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.189 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -63.82 -41.93 97.76 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.912 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.45 -37.3 77.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.635 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.622 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 92.0 t80 -61.36 -53.56 55.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.982 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.436 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.47 -50.53 71.48 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.115 0.483 . . . . 0.0 110.653 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.52 -43.52 98.62 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.137 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -65.32 -39.26 92.21 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.584 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.622 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 60.3 m80 -89.72 -4.63 57.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.548 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.436 ' N ' ' O ' ' A' ' 13' ' ' ALA . 62.8 t30 62.36 67.13 0.74 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.521 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.3 mt -129.17 147.65 51.04 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 120.872 0.368 . . . . 0.0 110.642 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -44.18 137.52 3.41 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.192 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.9 mt -50.23 144.1 11.93 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.073 -179.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -70.64 151.53 64.13 Favored 'Trans proline' 0 C--N 1.312 -1.344 0 C-N-CA 122.322 2.015 . . . . 0.0 111.881 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 68.1 t -127.7 130.47 70.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.118 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -105.28 153.18 21.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.67 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.456 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -118.0 143.86 46.04 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.416 178.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -120.48 127.35 52.14 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.832 0.349 . . . . 0.0 111.207 -179.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -137.85 130.49 29.67 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.794 178.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 . . . . . 0 CA--C 1.517 -0.309 0 CA-C-O 120.811 0.338 . . . . 0.0 110.452 -179.523 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 . . . . . 0 CA--C 1.513 -0.469 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -114.07 103.4 11.09 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.167 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 90.9 mtm180 -99.73 106.48 18.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.15 0.5 . . . . 0.0 109.867 -179.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.456 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 45.0 t -110.63 122.29 47.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.358 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -105.24 152.78 22.45 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.839 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.469 ' O ' HG13 ' A' ' 40' ' ' VAL . 5.0 p -121.48 120.1 60.89 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.282 0 CA-C-O 121.111 0.482 . . . . 0.0 110.246 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 94.8 m -95.18 121.69 37.08 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.107 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.42 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.1 t80 -140.73 136.25 32.36 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.803 0.335 . . . . 0.0 110.441 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 14.2 m 43.94 32.06 0.58 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.896 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.02 33.82 44.19 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 42' ' ' PHE . 86.5 mt-30 -136.69 122.97 20.56 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 29.8 p -103.32 108.23 19.38 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.895 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -90.97 140.28 29.98 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.768 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -143.12 144.64 32.3 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.426 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 39.3 t -87.4 159.97 18.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.493 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 86.4 p -89.7 -5.82 56.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.682 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -117.81 153.26 33.78 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.18 0.514 . . . . 0.0 110.052 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.67 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -103.46 133.21 48.89 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-O 121.856 0.836 . . . . 0.0 109.917 -179.289 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.428 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -87.64 145.93 38.18 Favored Pre-proline 0 C--N 1.311 -1.099 0 CA-C-N 114.045 -1.434 . . . . 0.0 110.748 179.879 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -76.38 -5.46 16.18 Favored 'Trans proline' 0 N--CA 1.496 1.623 0 C-N-CA 122.735 2.29 . . . . 0.0 112.433 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.1 p -136.21 155.89 49.47 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.027 0.441 . . . . 0.0 110.9 -179.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.15 -64.18 0.91 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.108 -178.656 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -52.7 -34.16 50.88 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.536 -177.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.6 m -56.48 -36.02 68.64 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.274 179.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.42 -38.4 71.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.03 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.33 -43.94 96.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.526 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.651 ' ND1' ' CE2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -61.71 -50.23 73.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.171 0.51 . . . . 0.0 110.588 179.826 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.58 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -66.82 -36.06 81.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.632 -179.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.72 -47.95 82.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.685 -179.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.415 ' O ' HG23 ' A' ' 68' ' ' VAL . . . -68.39 -32.51 72.62 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.594 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -58.79 -53.89 53.3 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.07 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.41 HG13 ' N ' ' A' ' 67' ' ' ALA . 13.6 pt -58.6 -44.6 89.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.44 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.41 ' N ' HG13 ' A' ' 66' ' ' ILE . . . -67.7 -45.03 76.3 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.984 0.421 . . . . 0.0 110.402 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 64' ' ' ALA . 16.1 t -60.35 -42.56 91.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.65 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.08 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.2 -27.45 68.99 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.458 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.514 179.646 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.8 m . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 120.7 0.286 . . . . 0.0 110.709 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -60.66 -40.97 94.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.878 0.37 . . . . 0.0 110.607 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -58.74 -40.5 84.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.544 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -70.77 -25.44 75.72 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 96.4 mm-40 -77.35 -48.62 16.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.193 0.52 . . . . 0.0 111.297 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.445 HD23 ' OH ' ' A' ' 23' ' ' TYR . 44.7 tp -62.55 -42.08 99.31 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.367 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -64.07 -42.25 97.06 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.724 -179.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.03 -36.82 78.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.374 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.605 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 91.2 t80 -61.73 -51.07 69.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.794 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.506 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -57.58 -48.02 80.53 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.01 0.433 . . . . 0.0 110.369 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.1 tp -62.74 -44.77 95.34 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.529 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -64.98 -38.97 92.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.689 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.605 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 64.6 m80 -93.09 -1.23 56.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.614 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.506 ' N ' ' O ' ' A' ' 13' ' ' ALA . 11.9 m120 55.92 65.29 1.48 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.532 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.2 mt -122.02 149.49 43.43 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.03 0.443 . . . . 0.0 110.326 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.515 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 55.6 mp0 -41.3 151.54 0.07 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.579 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.487 HD22 ' N ' ' A' ' 20' ' ' LEU . 3.5 mm? -61.54 137.74 94.86 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.914 -178.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.28 154.54 56.46 Favored 'Trans proline' 0 C--N 1.317 -1.101 0 C-N-CA 122.069 1.846 . . . . 0.0 112.004 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 68.6 t -133.17 134.87 57.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.537 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.445 ' OH ' HD23 ' A' ' 9' ' ' LEU . 29.5 m-85 -111.88 152.1 28.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.898 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.491 ' HB3' ' H ' ' A' ' 39' ' ' ASN . . . -109.84 144.78 37.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.079 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -127.08 120.34 28.72 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.915 0.388 . . . . 0.0 111.354 -179.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -133.45 127.66 33.8 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 . . . . . 0 CA--C 1.515 -0.384 0 CA-C-O 120.719 0.295 . . . . 0.0 110.378 -179.472 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 87.9 mtm-85 . . . . . 0 CA--C 1.512 -0.5 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -114.51 103.83 11.42 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 120.146 -0.622 . . . . 0.0 110.977 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.514 HH12 ' C ' ' A' ' 50' ' ' SER . 33.7 mmt180 -104.38 105.29 15.36 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.29 0.566 . . . . 0.0 110.03 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 74.1 m -114.23 134.18 55.1 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.309 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.491 ' H ' ' HB3' ' A' ' 24' ' ' ALA . 59.6 m-20 -110.14 157.89 18.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.353 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 p -122.42 120.75 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-O 121.202 0.525 . . . . 0.0 110.108 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 52.0 m -102.73 119.86 39.57 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.439 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.516 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.4 t80 -143.91 138.54 28.62 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.183 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.451 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 48.7 t 42.62 32.77 0.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.811 0.338 . . . . 0.0 110.909 179.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.27 30.27 59.0 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.516 ' N ' ' O ' ' A' ' 42' ' ' PHE . 99.1 mm-40 -125.19 119.23 27.95 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.817 0.342 . . . . 0.0 110.245 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 26.3 p -109.78 100.73 9.69 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.555 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -107.85 143.24 36.72 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.417 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.43 ' OE1' ' OD1' ' A' ' 39' ' ' ASN . 18.0 pt20 -153.52 154.04 33.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.772 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.3 p -82.35 162.21 22.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.403 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.514 ' C ' HH12 ' A' ' 37' ' ' ARG . 91.2 p -92.11 -3.11 56.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.577 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -109.77 153.28 24.57 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.239 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.629 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 1.0 OUTLIER -102.23 122.85 45.0 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 121.735 0.779 . . . . 0.0 109.923 -179.228 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.409 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.6 OUTLIER -78.34 148.98 75.05 Favored Pre-proline 0 C--N 1.306 -1.303 0 CA-C-N 114.144 -1.389 . . . . 0.0 110.748 -179.847 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -77.72 -6.48 16.12 Favored 'Trans proline' 0 N--CA 1.493 1.466 0 C-N-CA 122.628 2.218 . . . . 0.0 112.35 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -136.11 153.52 51.28 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.981 0.42 . . . . 0.0 110.384 -179.308 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.64 -60.32 3.48 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.007 -179.231 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -55.02 -34.09 63.19 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.927 -177.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.9 m -57.13 -35.88 70.01 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.206 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.53 -47.81 52.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.813 0.339 . . . . 0.0 111.283 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -62.56 -42.1 99.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.356 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -66.32 -45.74 79.27 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.683 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.45 -38.35 84.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.714 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.72 -48.0 82.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.552 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.452 ' O ' HG12 ' A' ' 68' ' ' VAL . . . -58.4 -38.69 77.86 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.402 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -55.12 -43.21 73.88 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.007 0.432 . . . . 0.0 110.107 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 62.4 mt -68.13 -42.95 85.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.439 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.413 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -65.48 -49.31 69.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.032 0.444 . . . . 0.0 111.657 -178.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.452 HG12 ' O ' ' A' ' 64' ' ' ALA . 8.8 p -67.25 -29.02 44.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.369 -179.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.8 -27.42 62.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.825 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 83.6 p . . . . . 0 C--N 1.331 -0.231 0 CA-C-O 121.051 0.453 . . . . 0.0 110.522 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 15.3 m . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.733 0.301 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.657 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 4.3 m-85 -61.27 -42.54 98.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.738 -179.221 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -59.35 -42.66 92.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.372 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.44 -24.29 63.43 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 111.229 -0.748 . . . . 0.0 111.229 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -76.92 -48.61 17.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.0 0.428 . . . . 0.0 110.938 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 33.6 tp -62.95 -41.52 99.53 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.09 -179.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -62.01 -41.75 98.4 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 119.701 -0.8 . . . . 0.0 110.614 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.61 -36.4 80.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.631 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.621 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 76.2 t80 -61.25 -51.18 70.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.596 -179.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.76 -48.96 76.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.084 0.468 . . . . 0.0 110.23 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.1 tp -62.68 -43.81 97.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.462 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -64.0 -40.31 96.08 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.626 -179.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 62.8 m80 -90.56 -4.94 56.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.63 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.476 ' N ' ' O ' ' A' ' 13' ' ' ALA . 63.3 t30 62.98 66.62 0.73 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.611 179.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.7 mt -127.67 148.3 50.39 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.457 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -45.78 136.94 5.8 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.932 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.0 mt -47.31 143.89 4.81 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.993 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -72.66 155.92 53.91 Favored 'Trans proline' 0 N--CA 1.494 1.509 0 C-N-CA 122.465 2.11 . . . . 0.0 112.016 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 74.9 t -129.58 130.34 67.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.445 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -106.55 152.4 23.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.333 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.453 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -113.68 145.86 40.69 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.388 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -125.02 121.96 35.89 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.742 0.306 . . . . 0.0 111.146 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -131.77 129.4 40.52 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 177.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.6 ttt-85 . . . . . 0 CA--C 1.516 -0.356 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.484 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 . . . . . 0 CA--C 1.516 -0.337 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -114.89 104.15 11.64 Favored 'General case' 0 CA--C 1.508 -0.642 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.187 179.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.8 mtp180 -100.52 105.94 17.43 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.674 -0.41 . . . . 0.0 109.9 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.453 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 44.1 t -110.63 125.26 53.24 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 120.96 0.41 . . . . 0.0 110.37 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -108.02 155.62 20.15 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.152 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.457 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.3 p -123.27 120.04 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.086 0.47 . . . . 0.0 110.347 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 95.4 m -97.92 119.27 36.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.233 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.491 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 5.3 t80 -140.07 139.44 35.9 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.337 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.491 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 6.2 m 44.11 32.25 0.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.6 32.32 54.67 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.496 -0.642 . . . . 0.0 111.496 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 42' ' ' PHE . 84.7 mt-30 -134.75 120.69 19.74 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.766 0.317 . . . . 0.0 110.253 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.2 m -102.72 107.68 18.65 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 121.02 0.438 . . . . 0.0 110.885 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -91.16 141.12 29.15 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.157 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -142.71 139.11 30.99 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.522 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.9 p -81.77 162.69 22.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.436 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.9 m -90.63 -9.24 47.69 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.732 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -120.99 142.37 49.85 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.266 0.555 . . . . 0.0 110.602 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.573 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.0 140.19 29.9 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.956 -179.368 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.411 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -92.33 147.93 35.49 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 114.711 -1.131 . . . . 0.0 111.12 -179.701 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -77.03 -4.61 15.07 Favored 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 122.807 2.338 . . . . 0.0 112.582 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.02 154.29 51.24 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.243 0.544 . . . . 0.0 111.143 -179.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.67 -64.86 0.78 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.632 -178.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -56.1 -35.45 67.04 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 120.731 0.301 . . . . 0.0 110.567 -177.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 40.2 t -56.45 -34.19 66.62 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.986 179.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.88 -39.46 79.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.27 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -62.43 -41.73 98.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.6 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.657 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -62.01 -52.17 65.06 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.162 0.506 . . . . 0.0 110.446 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.567 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -64.97 -37.24 86.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.743 -178.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.59 -45.46 91.81 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.437 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.482 ' O ' HG23 ' A' ' 68' ' ' VAL . . . -68.16 -34.09 75.67 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.906 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -59.35 -52.8 64.08 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 121.092 -0.243 . . . . 0.0 111.421 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.403 HG13 ' N ' ' A' ' 67' ' ' ALA . 12.4 pt -57.82 -45.57 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.124 -179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.403 ' N ' HG13 ' A' ' 66' ' ' ILE . . . -66.88 -43.36 83.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.083 0.468 . . . . 0.0 110.659 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 64' ' ' ALA . 18.4 t -60.6 -42.71 92.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.064 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.67 -27.72 69.42 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.696 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.4 m . . . . . 0 C--N 1.331 -0.228 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.818 -179.946 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.8 m . . . . . 0 N--CA 1.456 -0.148 0 CA-C-O 121.013 0.435 . . . . 0.0 110.738 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -60.91 -44.52 97.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.653 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -59.83 -42.55 93.8 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.598 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.47 -34.92 91.2 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -74.99 -44.51 47.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.063 0.459 . . . . 0.0 111.053 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.453 HD23 ' OH ' ' A' ' 23' ' ' TYR . 49.1 tp -62.97 -40.79 98.78 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.199 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -66.29 -40.06 89.8 Favored 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 119.901 -0.72 . . . . 0.0 110.785 -179.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.28 -40.15 89.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.449 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -62.91 -48.18 80.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.67 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.71 -40.27 62.84 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.381 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.413 ' O ' ' ND2' ' A' ' 17' ' ' ASN . 49.3 tp -63.49 -44.84 93.2 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.429 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.6 tp60 -70.29 -41.01 73.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.989 0.424 . . . . 0.0 111.122 -178.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.463 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 58.7 t-80 -74.0 -14.0 60.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.608 -179.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.413 ' ND2' ' O ' ' A' ' 14' ' ' LEU . 20.8 m120 54.83 69.0 0.78 Allowed 'General case' 0 C--O 1.233 0.198 0 C-N-CA 120.886 -0.325 . . . . 0.0 111.762 178.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -147.07 169.45 19.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.316 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -43.37 131.37 4.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.183 178.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.498 ' N ' HD12 ' A' ' 20' ' ' LEU . 10.9 mp -53.94 152.35 10.54 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.717 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -66.82 148.61 82.77 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 C-N-CA 122.447 2.098 . . . . 0.0 112.085 179.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 75.0 t -132.84 132.2 59.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.561 179.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.453 ' OH ' HD23 ' A' ' 9' ' ' LEU . 32.1 m-85 -107.99 151.32 25.98 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.468 179.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -126.16 131.96 51.92 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -112.65 137.61 50.67 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.854 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -139.84 150.39 44.61 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.6 ttt-85 . . . . . 0 CA--C 1.515 -0.366 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 -179.803 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 . . . . . 0 CA--C 1.516 -0.343 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -112.49 105.17 13.34 Favored 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 120.565 -0.454 . . . . 0.0 111.648 -178.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 -101.4 108.65 20.31 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.426 ' C ' HD22 ' A' ' 39' ' ' ASN . 62.0 m -115.01 143.67 44.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.921 0.391 . . . . 0.0 110.633 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.527 ' OD1' ' NE2' ' A' ' 48' ' ' GLN . 3.0 m120 -116.36 157.52 24.91 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.949 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.452 ' O ' HG13 ' A' ' 40' ' ' VAL . 3.7 p -124.31 121.06 60.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.928 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 64.7 m -96.37 124.67 40.45 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.622 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.478 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.1 t80 -146.35 139.64 25.8 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.238 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.495 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 42.9 t 42.99 32.79 0.45 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.915 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 74.98 28.06 63.26 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 42' ' ' PHE . 87.0 mt-30 -131.32 130.85 43.27 Favored 'General case' 0 C--O 1.233 0.211 0 O-C-N 122.724 -0.28 . . . . 0.0 110.42 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 63.6 p -108.76 104.63 13.95 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.968 0.414 . . . . 0.0 110.879 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -89.83 140.68 29.37 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.964 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.527 ' NE2' ' OD1' ' A' ' 39' ' ' ASN . 87.8 mt-30 -141.01 154.77 46.16 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.313 -179.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 42.8 m -100.45 157.78 16.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.52 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.9 t -89.53 -2.6 58.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.718 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -116.85 136.34 53.03 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.268 0.556 . . . . 0.0 110.308 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.579 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.68 144.95 24.81 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.71 -179.578 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.55 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -105.97 148.05 35.86 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 114.623 -1.171 . . . . 0.0 111.085 179.783 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.87 -3.54 13.61 Favored 'Trans proline' 0 N--CA 1.5 1.891 0 C-N-CA 122.938 2.425 . . . . 0.0 112.64 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.429 HG22 ' N ' ' A' ' 56' ' ' LEU . 89.3 m -134.88 154.24 51.74 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.04 0.447 . . . . 0.0 111.24 -179.187 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.429 ' N ' HG22 ' A' ' 55' ' ' THR . 0.4 OUTLIER -65.19 -62.98 1.22 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.506 -178.706 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.473 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 98.5 mttt -54.1 -33.57 58.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.738 0.304 . . . . 0.0 110.593 -177.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.5 m -56.95 -34.71 68.29 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.434 -0.507 . . . . 0.0 110.032 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.448 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -73.1 -44.28 60.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.45 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.25 -41.92 94.23 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.741 -179.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.476 ' ND1' ' N ' ' A' ' 61' ' ' HIS . 0.3 OUTLIER -61.81 -49.67 75.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.662 -179.727 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.51 -33.75 74.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.84 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.13 -49.19 77.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.825 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.67 -31.29 70.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.625 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -54.68 -46.21 74.03 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 121.124 -0.23 . . . . 0.0 110.75 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 23.3 pt -74.92 -30.88 24.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.817 0.341 . . . . 0.0 110.654 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.94 -52.07 22.08 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.125 0.488 . . . . 0.0 111.672 -179.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.1 p -61.71 -31.02 49.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.355 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.04 -28.64 64.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.731 179.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 78.0 p . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.734 -179.845 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.0 m . . . . . 0 N--CA 1.453 -0.316 0 CA-C-O 120.58 0.228 . . . . 0.0 110.742 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -56.22 -45.76 79.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.848 0.356 . . . . 0.0 111.067 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -59.99 -41.57 92.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.579 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.84 -30.79 72.49 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.48 -0.648 . . . . 0.0 111.48 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 -76.81 -48.91 17.12 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.213 0.53 . . . . 0.0 110.631 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.2 tp -61.97 -42.59 99.31 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.507 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.2 tp60 -65.29 -40.93 94.46 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.531 -179.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.76 -39.29 76.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.807 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.467 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 90.3 t80 -61.86 -49.93 74.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.151 -179.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.405 ' HB2' ' HZ ' ' A' ' 42' ' ' PHE . . . -55.89 -52.25 64.73 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.19 0.519 . . . . 0.0 110.592 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.68 -42.93 97.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.828 -179.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -53.71 -39.42 65.2 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.67 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.467 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 77.7 m80 -97.79 2.75 49.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.587 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.594 ' C ' HD12 ' A' ' 18' ' ' LEU . 62.3 t30 64.54 67.37 0.57 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.022 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.594 HD12 ' C ' ' A' ' 17' ' ' ASN . 9.5 mp -115.21 -172.97 2.23 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.545 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -91.77 139.77 30.35 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.941 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.588 ' N ' HD12 ' A' ' 20' ' ' LEU . 10.2 mp -47.53 141.9 6.7 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.03 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.98 158.19 42.42 Favored 'Trans proline' 0 N--CA 1.495 1.578 0 C-N-CA 122.87 2.38 . . . . 0.0 111.824 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.6 t -129.96 134.65 62.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.547 179.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -114.24 154.64 27.57 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.238 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -118.67 144.51 46.15 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.0 178.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -123.86 125.38 44.56 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.254 0.55 . . . . 0.0 111.162 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -134.39 127.75 32.23 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 . . . . . 0 CA--C 1.516 -0.336 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.187 -179.455 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 . . . . . 0 CA--C 1.512 -0.515 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -113.86 104.16 11.91 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.756 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -103.58 105.82 16.16 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.108 0.48 . . . . 0.0 109.978 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 69.4 m -115.28 133.39 56.08 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.119 0.485 . . . . 0.0 111.26 -179.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.415 ' OD1' ' NE2' ' A' ' 48' ' ' GLN . 97.7 m-20 -110.27 153.36 24.95 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.522 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.473 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.2 p -120.48 119.83 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.316 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.6 m -97.32 119.64 36.21 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.377 179.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.405 ' HZ ' ' HB2' ' A' ' 13' ' ' ALA . 7.2 t80 -143.18 139.63 30.41 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.462 -179.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.423 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 49.5 t 47.98 32.28 2.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.842 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.99 31.38 61.98 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -137.43 132.68 33.76 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 40.9 p -108.71 107.01 17.3 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.032 -179.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.42 ' HZ ' ' HG ' ' A' ' 70' ' ' SER . 48.0 m-85 -93.1 140.88 29.03 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.885 179.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.415 ' NE2' ' OD1' ' A' ' 39' ' ' ASN . 57.2 tt0 -151.5 146.9 26.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.337 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.0 p -85.57 164.31 17.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.695 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.0 p -90.24 -2.02 57.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.833 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -124.45 143.19 50.77 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.407 0.623 . . . . 0.0 110.808 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.644 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -91.45 143.14 26.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.54 -179.33 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.513 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -96.2 149.29 35.73 Favored Pre-proline 0 C--N 1.318 -0.8 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.132 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -77.23 -3.59 13.86 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 123.182 2.588 . . . . 0.0 112.752 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.424 ' O ' ' OG ' ' A' ' 58' ' ' SER . 0.8 OUTLIER -134.31 155.9 49.41 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.238 0.542 . . . . 0.0 110.757 -179.508 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.4 -66.01 0.65 Allowed 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.493 -178.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -53.22 -34.19 56.01 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.603 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.424 ' OG ' ' O ' ' A' ' 55' ' ' THR . 77.4 p -57.63 -33.27 68.09 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.579 179.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.41 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -71.11 -40.87 71.22 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.941 0.401 . . . . 0.0 110.888 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -65.37 -40.32 93.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.402 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 27.7 m170 -62.98 -50.31 71.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.749 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.25 -34.46 78.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.761 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.32 -46.35 86.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.598 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.77 -33.67 75.29 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.823 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 53.9 tttp -54.11 -46.03 72.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.587 0.232 . . . . 0.0 110.845 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.2 pt -74.84 -29.55 22.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.679 179.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.89 -51.49 25.88 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.471 -179.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.0 p -63.36 -29.01 46.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.281 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.82 -31.22 67.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 0.0 110.68 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.42 ' HG ' ' HZ ' ' A' ' 47' ' ' PHE . 37.1 t . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.675 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 31.3 m . . . . . 0 N--CA 1.454 -0.268 0 CA-C-O 120.863 0.363 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.523 ' CE1' ' NE2' ' A' ' 61' ' ' HIS . 4.4 m-85 -53.58 -45.02 69.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.792 -179.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -62.12 -41.09 97.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.637 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.48 -30.36 56.7 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.249 -0.741 . . . . 0.0 111.249 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -75.63 -47.32 26.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.808 0.337 . . . . 0.0 111.106 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 35.0 tp -61.56 -43.13 99.43 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.385 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -64.25 -41.52 96.92 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.836 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.06 -36.96 78.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.584 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.631 ' CE2' ' CE1' ' A' ' 16' ' ' HIS . 50.0 t80 -59.73 -50.69 72.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.823 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.4 -48.34 77.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.489 179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 47.7 tp -62.02 -43.71 98.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.611 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -63.69 -39.3 93.98 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.712 -179.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.631 ' CE1' ' CE2' ' A' ' 12' ' ' TYR . 57.8 m80 -89.36 2.48 54.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.549 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 61.6 t30 60.0 61.66 1.83 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.526 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.8 mt -131.2 148.52 52.71 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.599 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -48.29 134.67 14.48 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.016 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.556 ' N ' HD12 ' A' ' 20' ' ' LEU . 10.1 mp -48.51 150.02 2.6 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.858 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.92 152.57 63.43 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 C-N-CA 122.587 2.191 . . . . 0.0 111.934 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 79.6 t -129.2 128.76 67.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.415 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -104.82 152.49 22.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.402 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.465 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -126.0 132.68 51.97 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.207 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.482 ' ND2' ' SG ' ' A' ' 38' ' ' CYS . 8.3 m120 -110.39 136.44 49.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.956 0.407 . . . . 0.0 110.882 -178.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -139.74 149.69 43.91 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.022 179.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 . . . . . 0 C--O 1.232 0.161 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.762 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 . . . . . 0 CA--C 1.515 -0.397 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -111.49 106.84 15.85 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-O 121.203 0.525 . . . . 0.0 111.938 -179.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -100.28 108.28 20.3 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.482 ' SG ' ' ND2' ' A' ' 25' ' ' ASN . 35.3 t -111.74 134.5 53.27 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.834 -179.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -112.54 157.58 20.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.225 179.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.465 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.9 p -122.49 120.57 61.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-O 120.87 0.367 . . . . 0.0 110.277 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 93.8 m -95.66 121.17 37.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.562 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -144.1 132.28 21.8 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.019 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.476 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 44.9 t 49.43 32.21 4.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.904 0.383 . . . . 0.0 110.878 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.03 31.54 57.65 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 111.467 -0.653 . . . . 0.0 111.467 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -134.31 128.86 34.6 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 76.2 p -107.73 106.87 17.38 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.027 -179.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -92.82 142.23 27.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.122 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -138.39 160.08 40.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.376 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.9 t -100.32 161.12 13.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.437 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.0 p -90.99 -5.94 54.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.562 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.545 ' N ' ' OE1' ' A' ' 51' ' ' GLU . 55.9 mp0 -117.72 139.89 50.41 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.114 0.483 . . . . 0.0 110.495 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.576 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.62 145.32 24.91 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.919 -179.166 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.524 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -107.9 147.19 34.99 Favored Pre-proline 0 C--N 1.315 -0.913 0 CA-C-N 115.014 -0.993 . . . . 0.0 111.065 179.763 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -77.91 -3.41 13.48 Favored 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 122.736 2.291 . . . . 0.0 112.555 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 p -134.26 153.98 51.55 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.007 0.432 . . . . 0.0 111.064 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.17 -63.76 1.01 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.275 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -52.31 -34.41 46.8 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.995 -177.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 34.6 m -57.55 -33.39 68.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.856 0.36 . . . . 0.0 110.527 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.432 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -72.74 -46.22 54.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.164 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -59.04 -34.93 72.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.432 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.523 ' NE2' ' CE1' ' A' ' 5' ' ' TYR . 2.7 t-80 -62.31 -60.01 4.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.872 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.406 ' N ' ' ND1' ' A' ' 61' ' ' HIS . . . -64.91 -34.92 79.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.772 -179.365 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.98 -52.6 65.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.955 -179.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.58 -39.58 80.74 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.81 -179.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -57.18 -48.71 78.07 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.668 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 96.7 mt -56.82 -46.99 83.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.304 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.94 -45.8 73.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.025 0.44 . . . . 0.0 110.431 179.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.0 t -57.04 -41.25 77.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.004 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -66.49 -27.24 67.63 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.827 0.346 . . . . 0.0 110.675 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.4 m . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.734 179.961 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.5 m . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 120.784 0.326 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.657 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 5.7 m-85 -58.24 -45.58 87.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.717 -179.185 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -59.43 -41.98 90.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.969 0.414 . . . . 0.0 110.253 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.57 -32.54 83.59 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -76.51 -47.38 22.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.007 0.432 . . . . 0.0 111.158 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.8 tp -62.2 -42.55 99.4 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.303 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -62.61 -41.4 98.97 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 119.692 -0.803 . . . . 0.0 110.691 -178.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.42 -37.39 82.98 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.572 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.617 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 63.0 t80 -61.32 -50.96 70.87 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.669 -179.497 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.77 -47.28 80.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.971 0.415 . . . . 0.0 110.266 -179.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.5 tp -62.16 -45.38 93.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.503 -179.21 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -65.01 -38.18 90.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.506 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.617 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 62.4 m80 -91.17 2.28 56.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.536 -179.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 54.53 65.04 1.61 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.686 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.5 mt -127.65 151.32 49.09 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.089 0.471 . . . . 0.0 110.567 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -47.68 139.26 7.4 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.845 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 pp -52.68 146.19 18.82 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.902 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -72.35 153.24 55.92 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 122.5 2.133 . . . . 0.0 112.119 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.5 t -129.79 131.21 66.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.523 179.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -106.99 152.41 24.02 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.34 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -128.18 110.72 12.7 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 178.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.448 ' OD1' ' O ' ' A' ' 25' ' ' ASN . 40.7 p30 -107.3 144.14 34.56 Favored 'General case' 0 CA--C 1.517 -0.302 0 O-C-N 123.713 0.633 . . . . 0.0 110.987 -178.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.451 ' OE1' ' N ' ' A' ' 27' ' ' ARG . 0.7 OUTLIER -145.04 148.63 33.91 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.252 178.786 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.451 ' N ' ' OE1' ' A' ' 26' ' ' GLU . 61.7 ttp180 . . . . . 0 CA--C 1.516 -0.336 0 CA-C-O 120.648 0.261 . . . . 0.0 110.432 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.9 mmt180 . . . . . 0 CA--C 1.512 -0.497 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -115.04 102.19 9.7 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.332 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 85.7 mtp180 -101.16 106.93 18.22 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 9.9 t -114.87 129.21 56.66 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.016 -179.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -109.39 157.79 18.57 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.665 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.477 ' O ' HG13 ' A' ' 40' ' ' VAL . 5.4 p -125.24 121.32 60.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.196 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 99.1 m -98.52 123.93 42.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.737 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -146.23 132.81 19.81 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.312 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.476 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 51.8 t 47.84 45.14 18.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.837 0.351 . . . . 0.0 110.615 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 61.7 31.55 78.41 Favored Glycine 0 CA--C 1.522 0.505 0 N-CA-C 111.244 -0.742 . . . . 0.0 111.244 179.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.432 ' CG ' ' CE1' ' A' ' 47' ' ' PHE . 11.9 tp-100 -136.81 123.31 20.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.843 0.354 . . . . 0.0 110.167 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.97 109.62 21.68 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.299 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.472 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 60.0 m-85 -91.99 141.04 29.05 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.971 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.468 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 2.6 pm0 -149.71 156.02 41.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.176 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.6 t -96.52 170.75 9.0 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.429 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.5 p -99.21 -0.35 41.64 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.543 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -128.23 129.69 46.8 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.187 0.518 . . . . 0.0 110.706 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.92 148.0 32.85 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.992 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.479 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -99.2 147.62 33.52 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.165 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -74.88 -6.89 18.71 Favored 'Trans proline' 0 N--CA 1.497 1.71 0 C-N-CA 122.741 2.294 . . . . 0.0 112.457 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 p -133.45 155.0 50.33 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.221 0.534 . . . . 0.0 111.095 -179.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.77 -64.16 0.91 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.425 -178.549 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -53.71 -33.05 54.27 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.805 0.336 . . . . 0.0 110.381 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.4 t -56.92 -36.93 70.77 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.026 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.422 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -68.8 -45.45 71.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.457 -179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.62 -39.48 84.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.29 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . 0.657 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -64.32 -52.45 58.39 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.256 0.55 . . . . 0.0 110.735 179.949 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.566 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -65.63 -36.0 82.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.111 -178.553 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.81 -49.28 78.28 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.569 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.62 -32.1 70.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.787 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -54.77 -45.37 74.23 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.675 0.274 . . . . 0.0 110.832 -179.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 23.1 pt -74.08 -34.43 38.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 120.935 0.397 . . . . 0.0 110.677 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.53 -50.63 43.22 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.032 0.444 . . . . 0.0 111.666 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.5 p -63.07 -32.38 56.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.2 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.32 -28.08 65.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.57 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.472 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 18.5 m . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.688 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.1 m . . . . . 0 N--CA 1.457 -0.081 0 CA-C-O 120.724 0.297 . . . . 0.0 110.674 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -60.33 -45.97 91.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.684 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -61.08 -45.11 96.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.458 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.0 -34.84 90.95 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -73.24 -44.57 59.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.87 0.367 . . . . 0.0 111.227 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 45.6 tp -62.92 -41.19 99.38 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.417 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -64.37 -41.24 96.82 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 119.868 -0.733 . . . . 0.0 110.515 -179.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.73 -37.97 82.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.991 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.613 ' CE1' ' CD2' ' A' ' 16' ' ' HIS . 71.4 t80 -61.52 -50.69 71.69 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.825 -179.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.418 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -55.73 -47.69 76.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.931 0.396 . . . . 0.0 110.329 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.8 tt -63.16 -43.01 99.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.979 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -64.14 -40.97 97.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.627 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.613 ' CD2' ' CE1' ' A' ' 12' ' ' TYR . 78.7 m-70 -89.49 -4.24 58.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.765 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.418 ' N ' ' O ' ' A' ' 13' ' ' ALA . 64.7 t30 61.3 65.32 0.98 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.571 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 78.9 mt -128.51 148.83 50.77 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.601 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.594 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 1.5 mp0 -47.29 147.8 1.47 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.828 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.89 145.28 53.87 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.866 -179.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.68 153.02 64.96 Favored 'Trans proline' 0 N--CA 1.495 1.561 0 C-N-CA 122.4 2.067 . . . . 0.0 111.772 179.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 64.7 t -127.67 130.69 70.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.33 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -107.45 148.69 28.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.695 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.46 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -124.65 111.39 15.56 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.502 ' OD1' ' SG ' ' A' ' 38' ' ' CYS . 45.3 m-80 -109.88 143.55 39.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.735 0.302 . . . . 0.0 110.612 -178.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -148.0 151.25 35.44 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 . . . . . 0 CA--C 1.515 -0.373 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.587 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 . . . . . 0 CA--C 1.519 -0.23 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -111.39 105.98 14.76 Favored 'General case' 0 CA--C 1.5 -0.97 0 C-N-CA 120.266 -0.573 . . . . 0.0 111.744 -178.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 40.9 mtm180 -106.13 113.18 26.56 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.502 ' SG ' ' OD1' ' A' ' 25' ' ' ASN . 43.7 t -119.16 150.94 39.19 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.245 0.545 . . . . 0.0 110.97 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.422 ' OD1' ' NE2' ' A' ' 48' ' ' GLN . 94.7 m-20 -122.34 159.83 26.64 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.19 -0.913 . . . . 0.0 110.344 179.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.5 p -124.05 127.38 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.088 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 99.6 m -105.5 122.84 46.83 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.063 179.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.493 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.0 t80 -145.29 136.13 24.56 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 7.0 m 42.26 31.77 0.28 Allowed 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.057 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.83 25.92 61.55 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 120.994 -0.622 . . . . 0.0 111.653 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.493 ' N ' ' O ' ' A' ' 42' ' ' PHE . 85.3 mt-30 -120.44 124.57 45.78 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.724 0.297 . . . . 0.0 110.627 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.5 p -110.41 99.53 8.53 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.307 0.575 . . . . 0.0 111.012 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -100.3 140.6 34.32 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.211 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.422 ' NE2' ' OD1' ' A' ' 39' ' ' ASN . 57.2 tt0 -145.89 148.95 33.38 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.142 -179.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 44.0 t -87.73 161.72 17.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.378 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 79.0 p -91.6 -2.58 57.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.389 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -112.24 133.97 54.05 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.158 0.504 . . . . 0.0 110.532 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.585 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.68 144.65 25.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.648 -179.438 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.62 149.81 38.84 Favored Pre-proline 0 C--N 1.311 -1.092 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.976 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -80.4 -3.06 12.36 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 123.089 2.526 . . . . 0.0 112.666 179.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.77 147.69 50.42 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.327 0.584 . . . . 0.0 111.347 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.502 HD23 ' O ' ' A' ' 56' ' ' LEU . 2.1 tt -65.51 -61.51 2.06 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.865 -178.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -56.41 -35.83 68.25 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 120.795 0.331 . . . . 0.0 111.197 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 51.2 m -55.39 -33.35 63.39 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.754 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.31 -41.45 69.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.402 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.432 ' OE2' ' ND2' ' A' ' 25' ' ' ASN . 98.4 mt-10 -65.15 -41.73 94.47 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.92 -179.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -66.37 -45.62 79.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.052 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.01 -36.45 84.44 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.673 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.0 -40.82 86.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.184 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.405 ' O ' HG12 ' A' ' 68' ' ' VAL . . . -68.32 -33.81 74.99 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.824 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -55.22 -46.73 75.95 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.666 0.269 . . . . 0.0 111.173 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.404 HG12 ' H ' ' A' ' 66' ' ' ILE . 21.9 pt -71.85 -38.6 65.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.429 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.44 -49.28 61.03 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.405 HG12 ' O ' ' A' ' 64' ' ' ALA . 8.0 p -62.07 -31.04 50.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.886 0.374 . . . . 0.0 110.053 -179.155 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.88 -27.21 62.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.527 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 35.8 t . . . . . 0 C--N 1.332 -0.181 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.82 179.802 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.7 mmm . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.506 ' O ' ' ND1' ' A' ' 3' ' ' HIS . 44.8 p-10 -81.97 172.99 12.63 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.607 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.624 ' ND1' ' CD2' ' A' ' 61' ' ' HIS . 11.6 m-70 -138.87 57.8 1.66 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.804 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.6 m -101.24 -15.88 7.46 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.847 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -58.33 -44.56 88.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.887 0.375 . . . . 0.0 111.112 -178.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -60.07 -42.91 95.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.009 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.53 -31.84 82.22 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 111.146 -0.781 . . . . 0.0 111.146 179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -76.22 -46.92 25.95 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.671 0.272 . . . . 0.0 111.415 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.429 HD23 ' OH ' ' A' ' 23' ' ' TYR . 51.0 tp -62.35 -41.32 98.49 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.435 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -64.74 -43.09 94.46 Favored 'General case' 0 N--CA 1.44 -0.95 0 C-N-CA 119.821 -0.752 . . . . 0.0 110.323 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.51 -39.06 85.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.735 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE2' ' CE1' ' A' ' 16' ' ' HIS . 55.9 t80 -62.45 -52.45 63.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.729 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.69 -49.47 76.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.82 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.7 tp -63.47 -45.24 91.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.831 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -64.71 -39.86 94.37 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.542 -178.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE2' ' A' ' 12' ' ' TYR . 72.9 m80 -86.21 -7.3 58.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.67 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 63.1 t30 62.91 66.0 0.77 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.417 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.9 mt -127.55 148.18 50.34 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.641 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -44.71 137.22 4.02 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 121.07 0.462 . . . . 0.0 109.994 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.6 mt -48.98 144.3 7.64 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.732 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.53 154.7 55.25 Favored 'Trans proline' 0 N--CA 1.495 1.607 0 C-N-CA 122.398 2.065 . . . . 0.0 111.979 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.8 t -130.04 130.63 66.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-O 121.246 0.546 . . . . 0.0 110.792 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.429 ' OH ' HD23 ' A' ' 9' ' ' LEU . 33.8 m-85 -106.9 152.89 23.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.874 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -116.6 143.74 45.24 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.547 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -121.2 124.81 45.6 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 120.691 0.281 . . . . 0.0 111.197 -179.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -134.73 132.79 39.23 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 58.2 ttp180 -133.9 119.56 19.27 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -159.2 133.23 7.57 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 150.98 141.77 3.41 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.247 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_exo -43.48 166.42 0.03 OUTLIER 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 121.877 1.718 . . . . 0.0 112.55 179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -54.28 -50.19 14.39 Favored 'Trans proline' 0 N--CA 1.502 1.998 0 C-N-CA 122.464 2.109 . . . . 0.0 113.013 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -88.47 4.34 46.9 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.586 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.14 61.41 20.83 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.462 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -82.08 143.24 12.72 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 C-N-CA 122.628 2.218 . . . . 0.0 111.457 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 85.9 mtt85 -132.87 131.23 40.73 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -114.48 103.34 10.94 Favored 'General case' 0 CA--C 1.501 -0.941 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.112 179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -102.76 107.17 17.95 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.522 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.414 ' O ' ' OE1' ' A' ' 48' ' ' GLN . 69.8 m -113.26 129.82 56.42 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.427 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.421 ' OD1' ' OE1' ' A' ' 48' ' ' GLN . 60.0 m-80 -105.56 150.85 25.01 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.77 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.423 ' O ' HG13 ' A' ' 40' ' ' VAL . 3.0 p -120.36 119.68 60.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 98.5 m -97.32 122.3 40.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.307 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -144.64 135.95 25.31 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.324 -0.398 . . . . 0.0 109.965 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.492 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 43.4 t 47.35 36.3 4.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.925 0.393 . . . . 0.0 110.907 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.454 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 69.56 32.11 71.09 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.332 -0.707 . . . . 0.0 111.332 179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.454 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 98.8 mm-40 -135.17 128.27 31.73 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.731 0.301 . . . . 0.0 110.39 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 55.2 p -107.53 106.83 17.39 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.979 0.419 . . . . 0.0 111.129 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -92.72 141.71 28.16 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.039 179.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.421 ' OE1' ' OD1' ' A' ' 39' ' ' ASN . 69.9 tp60 -152.89 145.55 24.27 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.416 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 92.6 p -86.94 161.2 18.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.412 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.0 p -88.65 -4.05 58.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.895 0.378 . . . . 0.0 110.101 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -112.96 146.62 38.69 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.516 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.68 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -99.96 135.85 40.77 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 121.893 0.854 . . . . 0.0 109.538 -179.97 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.433 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -89.59 150.72 44.83 Favored Pre-proline 0 C--N 1.307 -1.259 0 CA-C-N 114.119 -1.401 . . . . 0.0 110.723 -179.544 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -79.76 -4.57 13.52 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 C-N-CA 122.496 2.13 . . . . 0.0 112.465 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.42 153.44 51.79 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.936 0.398 . . . . 0.0 111.02 -179.145 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.23 -62.82 1.32 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.657 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -55.66 -32.91 63.62 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 120.802 0.334 . . . . 0.0 110.734 -177.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.2 t -56.84 -37.79 71.76 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.829 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.14 -41.71 81.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.057 179.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -63.5 -44.05 95.48 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.753 0.311 . . . . 0.0 110.841 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.624 ' CD2' ' ND1' ' A' ' 3' ' ' HIS . 32.7 m-70 -62.06 -48.03 82.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.394 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.52 -36.01 81.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.533 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.65 -48.19 81.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.369 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.68 -33.32 75.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.953 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -54.97 -47.33 74.69 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.614 0.245 . . . . 0.0 111.061 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.4 pt -74.08 -32.21 32.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.5 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.425 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -68.37 -50.29 54.18 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.769 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 p -65.1 -29.98 48.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.743 0.306 . . . . 0.0 110.502 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.24 -33.59 73.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.916 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.425 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 86.1 p -67.3 -38.67 85.37 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.956 0.408 . . . . 0.0 110.566 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 53.8 mt -67.24 -31.53 71.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.693 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 29.1 m . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.585 -179.98 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.3 mtm . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.411 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 95.9 m-20 -69.85 141.13 53.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.36 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.456 ' O ' ' CD2' ' A' ' 3' ' ' HIS . 55.7 p-80 -159.34 43.59 0.24 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.775 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.2 m -93.78 -15.29 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-O 120.737 0.303 . . . . 0.0 110.855 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -57.91 -44.82 87.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.719 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -58.1 -42.54 85.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.365 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -66.92 -29.74 75.08 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -77.22 -49.3 15.42 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.009 0.433 . . . . 0.0 111.264 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 56.2 tp -62.84 -41.82 99.5 Favored 'General case' 0 CA--C 1.506 -0.723 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.445 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -64.7 -40.41 95.32 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 119.538 -0.865 . . . . 0.0 110.611 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.32 -38.32 81.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.557 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -62.13 -49.78 74.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.803 -179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.412 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -57.33 -47.88 80.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.881 0.372 . . . . 0.0 110.39 -179.518 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.2 tp -61.89 -46.2 90.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.615 -179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -65.7 -39.59 91.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.781 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.499 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 60.0 t-80 -88.37 -0.87 57.64 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.601 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.412 ' N ' ' O ' ' A' ' 13' ' ' ALA . 80.7 m-20 56.17 65.54 1.41 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.671 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 81.7 mt -127.07 148.87 50.13 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.413 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -46.34 134.58 8.79 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.752 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.3 mt -46.91 144.8 3.56 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.692 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.89 153.5 63.72 Favored 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 122.215 1.944 . . . . 0.0 111.878 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 73.6 t -129.83 130.43 66.52 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.339 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 31.8 m-85 -106.37 152.77 23.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.41 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.474 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -117.53 140.54 49.48 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.279 178.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -119.47 125.66 49.44 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.962 0.41 . . . . 0.0 111.319 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -135.0 133.84 39.86 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.061 178.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 69.8 ttp85 -133.42 119.99 20.34 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.172 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -159.1 132.77 7.39 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.495 -0.482 . . . . 0.0 109.751 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 150.08 143.37 3.73 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 120.444 -0.884 . . . . 0.0 111.272 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -43.83 165.94 0.04 OUTLIER 'Trans proline' 0 N--CA 1.491 1.334 0 C-N-CA 121.914 1.743 . . . . 0.0 112.61 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.41 -51.37 11.08 Favored 'Trans proline' 0 N--CA 1.499 1.833 0 C-N-CA 122.539 2.159 . . . . 0.0 112.841 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 51.5 p-80 -88.06 5.84 39.1 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.565 -179.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.33 60.95 18.27 Favored Pre-proline 0 C--N 1.332 -0.191 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.825 178.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -81.1 142.29 13.52 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 122.668 2.245 . . . . 0.0 111.545 178.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 91.1 mtm180 -131.29 130.15 42.43 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -113.67 103.55 11.34 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.217 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -99.62 106.33 18.29 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.474 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 45.1 t -112.23 124.42 52.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.489 -179.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -107.77 151.58 25.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.079 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.462 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.0 p -120.59 120.03 61.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.303 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.165 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 87.2 m -96.07 121.42 37.8 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.283 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.556 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 5.0 t80 -142.18 138.99 31.93 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.189 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.556 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 4.0 m 45.25 31.98 0.9 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.743 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 74.88 32.17 57.22 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 42' ' ' PHE . 86.6 mt-30 -136.59 126.76 26.29 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 45.7 p -104.86 106.89 17.58 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.957 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -91.3 140.95 29.3 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.201 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -150.1 150.77 32.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.372 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 29.3 t -91.31 164.38 13.88 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.515 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.8 m -89.41 -7.39 55.28 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.584 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -117.66 136.9 53.02 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.323 0.582 . . . . 0.0 110.188 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.526 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -90.22 144.13 26.13 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.55 -179.07 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.477 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -95.61 148.97 35.44 Favored Pre-proline 0 C--N 1.317 -0.806 0 CA-C-N 114.757 -1.11 . . . . 0.0 111.174 -179.66 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -80.37 -3.81 12.74 Favored 'Trans proline' 0 N--CA 1.494 1.547 0 C-N-CA 122.848 2.365 . . . . 0.0 111.941 179.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.14 154.02 47.92 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.228 0.537 . . . . 0.0 110.822 -179.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.1 tt -70.25 -64.99 0.78 Allowed 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.475 -178.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -55.19 -35.53 64.92 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 120.98 0.419 . . . . 0.0 110.554 -178.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.3 m -55.32 -34.8 64.51 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.016 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.436 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -70.81 -40.3 72.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.782 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -63.03 -41.25 99.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.331 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.411 ' ND1' ' O ' ' A' ' 2' ' ' ASP . 35.6 m170 -63.76 -49.22 73.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.794 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.57 -35.43 79.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.926 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.94 -48.64 79.34 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.783 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.47 -33.53 74.34 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.053 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -54.9 -45.24 74.69 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.685 0.279 . . . . 0.0 111.456 -179.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 22.1 pt -73.27 -33.94 42.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.578 179.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.59 -50.52 43.81 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.705 -178.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.9 p -63.49 -32.26 56.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.188 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.25 -30.24 68.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.715 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.7 m -67.33 -42.06 84.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.762 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 52.1 mt -67.07 -30.47 70.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.756 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 59.8 p . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 118.136 -0.935 . . . . 0.0 110.638 -179.62 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.3 mtt . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' A' ' 3' ' ' HIS . 68.1 t0 -65.47 137.72 57.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.46 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.622 ' ND1' ' NE2' ' A' ' 61' ' ' HIS . 23.9 m170 -82.94 75.09 9.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.569 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.404 ' H ' HG22 ' A' ' 4' ' ' VAL . 18.7 m -96.77 -15.75 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.76 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -56.45 -46.17 80.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.804 -179.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -60.83 -41.98 96.85 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.632 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.85 -33.44 85.79 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -77.74 -49.87 13.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.237 0.541 . . . . 0.0 111.235 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 29.5 tp -62.09 -42.32 99.09 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.169 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -62.85 -41.89 99.54 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.683 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.83 -36.54 80.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.49 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.621 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 83.1 t80 -61.22 -50.61 72.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.816 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.41 -51.53 69.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.904 0.383 . . . . 0.0 110.663 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 51.2 tp -62.85 -44.12 96.99 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.732 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 69.8 tp60 -64.11 -38.49 91.25 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.569 -178.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 68.1 m80 -91.78 -0.46 57.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.718 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 64.7 t30 58.04 66.33 1.13 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.592 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.9 mt -127.93 146.62 50.58 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.017 0.437 . . . . 0.0 110.575 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.512 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 57.0 mp0 -42.62 133.4 3.44 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.103 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.546 HD12 ' N ' ' A' ' 20' ' ' LEU . 10.5 mp -47.2 145.55 3.55 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.691 -178.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.42 153.71 55.6 Favored 'Trans proline' 0 N--CA 1.492 1.441 0 C-N-CA 122.497 2.131 . . . . 0.0 111.881 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 67.3 t -128.85 131.87 67.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.324 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -107.34 152.88 23.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.672 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -115.91 144.47 44.0 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.456 178.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -124.95 123.6 40.23 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.288 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 83.9 mt-10 -133.87 130.72 38.24 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 72.1 ttp85 -130.14 119.99 23.88 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 120.788 0.328 . . . . 0.0 110.286 -179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -158.87 131.94 7.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.081 0.467 . . . . 0.0 109.898 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.67 141.88 3.49 Favored Glycine 0 CA--C 1.533 1.17 0 C-N-CA 120.432 -0.889 . . . . 0.0 111.223 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_exo -43.88 165.01 0.04 OUTLIER 'Trans proline' 0 C--N 1.314 -1.276 0 C-N-CA 122.222 1.948 . . . . 0.0 112.419 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -53.46 -50.97 12.04 Favored 'Trans proline' 0 N--CA 1.496 1.669 0 C-N-CA 122.48 2.12 . . . . 0.0 112.734 179.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -86.55 3.24 45.1 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.545 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.08 60.95 18.98 Favored Pre-proline 0 C--N 1.331 -0.204 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.893 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -80.8 143.45 14.73 Favored 'Trans proline' 0 C--N 1.311 -1.434 0 C-N-CA 122.642 2.228 . . . . 0.0 111.951 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 87.5 mtm180 -133.18 130.16 38.76 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -114.22 103.78 11.44 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.036 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -102.34 105.36 15.96 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.12 0.486 . . . . 0.0 109.731 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 69.0 m -114.08 132.93 55.86 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.452 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -111.41 155.52 23.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.293 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.421 ' O ' HG13 ' A' ' 40' ' ' VAL . 2.9 p -121.11 119.9 60.62 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.301 0 CA-C-O 120.923 0.392 . . . . 0.0 109.95 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 74.8 m -97.33 124.88 41.61 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.681 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -146.08 136.83 24.29 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.125 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.441 ' SG ' ' O ' ' A' ' 43' ' ' CYS . 49.6 t 46.76 32.82 1.88 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.808 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.45 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 74.11 32.85 57.98 Favored Glycine 0 CA--C 1.522 0.482 0 N-CA-C 111.236 -0.745 . . . . 0.0 111.236 179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 98.8 mm-40 -136.56 123.62 21.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.804 0.335 . . . . 0.0 110.217 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.2 p -106.13 108.73 20.4 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.115 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -94.5 141.6 28.4 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.007 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -147.86 145.91 28.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.892 0.377 . . . . 0.0 110.422 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.1 p -84.7 163.18 19.36 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.307 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.1 p -90.86 -2.51 57.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.536 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -118.29 154.43 32.3 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.222 0.534 . . . . 0.0 110.105 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.687 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -103.68 134.26 47.31 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.909 -179.405 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.43 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -88.02 147.54 40.99 Favored Pre-proline 0 C--N 1.311 -1.107 0 CA-C-N 114.281 -1.327 . . . . 0.0 110.935 -179.838 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.15 -5.33 16.16 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.759 2.306 . . . . 0.0 112.381 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.429 ' O ' ' OG ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -136.06 155.79 49.69 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.001 0.429 . . . . 0.0 111.107 -179.216 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.97 -64.13 0.92 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.93 -178.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -54.22 -36.17 63.22 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.937 -177.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 55' ' ' THR . 77.8 p -56.05 -33.02 64.58 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.14 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.42 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -71.67 -42.24 67.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.896 0.379 . . . . 0.0 111.128 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -64.21 -42.14 96.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.532 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.622 ' NE2' ' ND1' ' A' ' 3' ' ' HIS . 43.7 m-70 -66.17 -46.8 76.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.718 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.66 -37.98 83.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.762 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.25 -45.47 94.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.687 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.6 -37.07 77.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.364 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.36 -50.03 75.1 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.356 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 96.6 mt -57.82 -47.78 85.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.216 -178.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.6 -43.88 88.3 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.008 0.432 . . . . 0.0 110.501 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.2 t -59.48 -41.21 83.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.142 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.08 -29.88 70.78 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.652 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 19.7 m -65.17 -41.63 94.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.793 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 56.4 mt -67.59 -29.87 69.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.541 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 43.1 p . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.626 -179.767 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.6 mmm . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -63.17 -42.49 99.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.593 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.51 ' O ' ' CG ' ' A' ' 3' ' ' HIS . 36.2 p-80 -167.26 59.12 0.08 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.589 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.5 m -99.41 -14.93 7.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.452 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -60.31 -44.94 94.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.796 0.332 . . . . 0.0 110.815 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -59.1 -41.66 88.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.533 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.6 -28.01 73.44 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -77.64 -49.61 14.18 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.021 0.438 . . . . 0.0 111.018 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.1 tp -61.63 -42.16 98.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.723 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -62.23 -40.14 95.17 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.833 -179.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.28 -38.07 78.18 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.408 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.618 ' CE1' ' CD2' ' A' ' 16' ' ' HIS . 83.9 t80 -62.05 -51.7 66.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.609 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.492 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.81 -49.21 76.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.514 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 51.5 tp -62.41 -44.79 95.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.636 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -65.35 -39.48 92.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.588 -179.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.618 ' CD2' ' CE1' ' A' ' 12' ' ' TYR . 66.5 m-70 -90.28 -5.71 55.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.6 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.492 ' N ' ' O ' ' A' ' 13' ' ' ALA . 64.5 t30 60.72 67.12 0.85 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.559 179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 75.7 mt -126.66 148.12 49.86 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.937 0.398 . . . . 0.0 110.584 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.568 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 55.4 mp0 -42.51 131.92 3.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.269 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 pp -46.08 144.57 2.93 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.635 -179.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -72.53 155.42 54.93 Favored 'Trans proline' 0 C--N 1.308 -1.585 0 C-N-CA 122.769 2.313 . . . . 0.0 112.167 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 59.1 t -130.69 132.02 64.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.458 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -108.88 153.54 23.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.765 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -116.16 144.06 44.67 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.817 178.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -123.61 122.91 39.37 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.937 -179.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -132.39 126.84 34.1 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.735 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -129.99 118.99 22.47 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.844 0.354 . . . . 0.0 110.374 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.53 ' CD ' HH21 ' A' ' 37' ' ' ARG . 11.5 pt-20 -159.55 134.66 8.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.344 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 147.79 144.0 3.92 Favored Glycine 0 CA--C 1.531 1.046 0 N-CA-C 111.144 -0.782 . . . . 0.0 111.144 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -42.49 162.87 0.04 OUTLIER 'Trans proline' 0 C--N 1.309 -1.509 0 C-N-CA 122.666 2.244 . . . . 0.0 112.425 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -53.45 -48.08 23.86 Favored 'Trans proline' 0 N--CA 1.493 1.447 0 C-N-CA 122.523 2.149 . . . . 0.0 112.433 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 56.8 p-80 -89.56 5.16 46.79 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.62 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.7 60.65 16.55 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.66 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -79.65 142.92 16.48 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 122.597 2.198 . . . . 0.0 111.901 178.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 85.0 mtt85 -131.56 128.94 40.3 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.212 179.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -113.65 104.03 11.82 Favored 'General case' 0 C--O 1.217 -0.635 0 C-N-CA 120.479 -0.488 . . . . 0.0 111.335 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.53 HH21 ' CD ' ' A' ' 28' ' ' GLU . 86.9 mtm180 -106.21 104.38 14.07 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 81.2 m -113.08 133.53 54.96 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.309 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -111.34 153.98 25.21 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.313 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.442 ' O ' HG13 ' A' ' 40' ' ' VAL . 3.4 p -121.3 119.7 59.88 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 121.032 0.444 . . . . 0.0 110.159 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 98.0 m -97.07 123.3 40.78 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.788 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -145.26 136.95 25.39 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.325 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.492 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 43.9 t 46.54 36.05 3.34 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.528 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.433 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 70.56 32.77 67.48 Favored Glycine 0 CA--C 1.52 0.371 0 N-CA-C 111.192 -0.763 . . . . 0.0 111.192 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.433 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 98.2 mm-40 -136.25 125.54 24.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.722 0.296 . . . . 0.0 110.342 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.0 p -106.83 107.54 18.61 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.965 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.406 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 54.5 m-85 -92.85 140.94 28.98 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.008 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -147.65 151.08 35.58 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.392 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.6 m -88.74 160.68 17.19 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.463 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 86.8 p -86.37 -7.74 58.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.548 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -127.64 132.16 49.78 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.412 0.625 . . . . 0.0 110.771 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -80.28 148.75 30.61 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.136 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.556 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -98.1 149.69 35.99 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.875 -179.756 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -75.68 -4.39 15.17 Favored 'Trans proline' 0 C--N 1.311 -1.41 0 C-N-CA 122.764 2.309 . . . . 0.0 112.357 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.445 ' OG1' ' OG ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -130.54 153.23 49.07 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.235 0.541 . . . . 0.0 110.722 -179.343 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.1 tt -69.7 -66.46 0.59 Allowed 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.293 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -53.41 -36.59 61.65 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.515 -178.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.445 ' OG ' ' OG1' ' A' ' 55' ' ' THR . 79.1 p -54.73 -32.38 59.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.284 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.27 -40.73 70.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.856 0.36 . . . . 0.0 110.813 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -64.91 -38.67 91.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.477 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 22.9 m170 -64.58 -51.77 61.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.81 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.38 -34.33 77.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.645 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.19 -46.76 85.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.639 -179.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.03 -32.71 70.98 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.651 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -54.18 -45.34 72.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.825 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.8 pt -74.22 -32.87 33.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.068 0.461 . . . . 0.0 110.804 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.18 -50.27 41.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.239 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.6 p -64.36 -31.18 52.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.626 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.42 -28.78 65.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.524 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.406 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 15.6 m -70.06 -39.82 75.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.063 0.458 . . . . 0.0 110.661 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 51.5 mt -67.37 -29.56 69.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.566 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 82.0 p . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.46 -179.817 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.2 mtm . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 54.99 33.87 21.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.519 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.633 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 6.2 t60 -73.58 60.52 0.67 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.768 -179.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.401 ' H ' HG22 ' A' ' 4' ' ' VAL . 24.1 m -92.67 -15.24 8.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.999 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -59.19 -44.37 92.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.834 -179.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -58.51 -43.09 88.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.258 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.41 -28.27 73.33 Favored Glycine 0 CA--C 1.527 0.809 0 N-CA-C 111.234 -0.746 . . . . 0.0 111.234 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -77.4 -49.58 14.58 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.88 0.372 . . . . 0.0 110.978 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 59.0 tp -63.21 -41.2 99.1 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.323 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -62.49 -41.28 98.69 Favored 'General case' 0 C--N 1.311 -1.101 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.623 -179.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.09 -37.85 81.68 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.934 179.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 80.5 t80 -61.67 -51.22 69.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.775 -179.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.32 -48.5 80.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.434 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.3 tp -62.73 -44.24 96.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.469 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.9 tp60 -65.24 -40.19 93.71 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.601 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 69.1 m80 -89.55 -1.69 58.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.692 -179.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 60.9 t-20 58.59 65.95 1.16 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.546 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.8 mt -127.4 151.15 49.17 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.583 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -45.58 129.52 8.75 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.722 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.487 HD23 ' H ' ' A' ' 20' ' ' LEU . 0.2 OUTLIER -46.35 146.27 2.4 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.598 -178.876 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.26 152.88 66.97 Favored 'Trans proline' 0 N--CA 1.494 1.501 0 C-N-CA 122.396 2.064 . . . . 0.0 112.041 179.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.1 t -129.83 129.39 66.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.535 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -104.73 152.61 22.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.331 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.458 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -117.93 145.24 44.82 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.526 178.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -121.5 125.62 47.26 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.665 0.269 . . . . 0.0 111.245 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -134.69 123.64 24.02 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 -125.02 113.47 17.82 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -148.95 128.48 13.12 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.78 139.35 3.06 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 120.488 -0.863 . . . . 0.0 111.331 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -44.1 166.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 121.875 1.717 . . . . 0.0 112.743 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -54.93 -47.7 25.21 Favored 'Trans proline' 0 N--CA 1.502 1.974 0 C-N-CA 122.357 2.038 . . . . 0.0 112.455 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -86.47 -0.55 56.28 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.526 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -138.84 60.57 19.17 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.709 178.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -81.93 144.49 13.62 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 122.6 2.2 . . . . 0.0 111.731 178.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.401 ' NH2' ' CD1' ' A' ' 52' ' ' PHE . 82.8 mtp180 -131.86 131.0 42.41 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 178.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -114.96 103.83 11.31 Favored 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 120.161 -0.616 . . . . 0.0 111.296 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.7 mtm180 -101.77 106.36 17.35 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.077 0.465 . . . . 0.0 110.226 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.458 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 42.1 t -109.79 124.5 51.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.375 -179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -106.63 150.55 26.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.711 179.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.433 ' O ' HG13 ' A' ' 40' ' ' VAL . 3.4 p -119.28 119.46 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.11 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 94.8 m -94.66 120.19 34.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.212 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.486 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 4.5 t80 -141.36 138.01 32.74 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.203 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.486 ' SG ' ' O ' ' A' ' 42' ' ' PHE . 13.8 p 41.9 44.13 2.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.945 0.402 . . . . 0.0 110.718 179.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 64.64 32.63 84.84 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.443 ' N ' ' O ' ' A' ' 42' ' ' PHE . 47.6 tp60 -137.73 122.51 18.76 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.912 0.387 . . . . 0.0 110.384 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 32.7 p -103.69 109.08 20.64 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.129 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.499 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 15.9 m-85 -89.9 140.74 29.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.859 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -144.95 154.01 42.13 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.341 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.1 m -98.62 159.85 14.67 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.415 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 93.7 p -89.88 -6.88 55.35 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.56 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -116.26 148.88 40.03 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.146 0.498 . . . . 0.0 110.189 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.689 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -101.59 131.26 47.88 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-N 115.228 -0.897 . . . . 0.0 109.822 -179.331 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.462 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -85.98 148.84 49.06 Favored Pre-proline 0 C--N 1.307 -1.247 0 CA-C-N 114.142 -1.39 . . . . 0.0 110.688 -179.566 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -77.42 -5.17 15.39 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 122.395 2.064 . . . . 0.0 112.563 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.4 HG22 ' N ' ' A' ' 56' ' ' LEU . 48.7 m -135.43 153.09 51.9 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.255 0.55 . . . . 0.0 111.179 -179.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.4 ' N ' HG22 ' A' ' 55' ' ' THR . 0.5 OUTLIER -64.7 -62.56 1.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.554 -178.782 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.47 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 69.0 mttm -55.07 -33.63 62.91 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 120.992 0.425 . . . . 0.0 110.601 -177.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.4 t -56.46 -36.93 69.62 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.003 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.87 -41.62 74.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.7 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -61.13 -40.81 95.2 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.42 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.633 ' ND1' ' CE1' ' A' ' 3' ' ' HIS . 0.4 OUTLIER -67.5 -44.87 77.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.656 -179.525 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.92 -40.85 87.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.074 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.77 -50.68 72.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.682 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.459 ' O ' HG12 ' A' ' 68' ' ' VAL . . . -61.33 -37.73 84.34 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.351 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -55.81 -45.89 78.17 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.881 0.372 . . . . 0.0 110.324 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 96.7 mt -65.62 -43.82 93.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.862 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.24 -49.56 64.01 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -178.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 64' ' ' ALA . 8.4 p -65.05 -31.77 55.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.175 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.95 -27.56 65.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.633 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 59.7 p -71.53 -39.18 70.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.599 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 49.9 mt -67.51 -31.25 71.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.75 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 62.7 m . . . . . 0 C--O 1.221 -0.418 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.562 179.986 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.5 mtt . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -69.21 146.68 52.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.339 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.632 ' ND1' ' CD2' ' A' ' 61' ' ' HIS . 79.5 m-70 -123.07 31.85 5.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.604 -179.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 32.7 m -84.47 -20.16 8.76 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.094 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -55.77 -43.74 77.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.828 0.346 . . . . 0.0 110.923 -178.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -59.88 -42.59 94.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.437 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -74.55 -26.32 67.95 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 111.66 -0.576 . . . . 0.0 111.66 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -77.17 -49.02 16.1 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.655 0.264 . . . . 0.0 111.506 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.6 tp -63.58 -41.37 98.38 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.179 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -65.12 -42.13 94.22 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.257 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.14 -37.57 84.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.667 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 92.4 t80 -61.5 -48.93 78.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.657 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.441 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.82 -45.83 82.06 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.798 0.332 . . . . 0.0 110.521 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.3 tp -62.86 -46.17 89.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.729 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -66.04 -42.68 89.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.966 0.413 . . . . 0.0 110.627 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.481 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 66.9 t-80 -84.8 -5.43 59.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.831 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.441 ' N ' ' O ' ' A' ' 13' ' ' ALA . 61.7 t-20 58.66 65.46 1.24 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.716 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.407 HD21 ' ND1' ' A' ' 16' ' ' HIS . 80.5 mt -123.38 148.37 46.14 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.683 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -41.72 152.64 0.07 Allowed 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.302 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.445 ' CD2' ' N ' ' A' ' 20' ' ' LEU . 3.6 mm? -61.61 139.43 95.18 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.468 -178.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -72.07 152.89 57.32 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 122.362 2.042 . . . . 0.0 112.013 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 72.2 t -131.45 130.96 63.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.935 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -107.28 152.22 24.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.422 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.442 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -115.94 141.53 47.99 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 115.602 -0.727 . . . . 0.0 109.133 178.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -119.8 125.14 47.84 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.751 0.31 . . . . 0.0 111.353 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -134.01 128.69 34.87 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -131.11 119.72 22.35 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -158.4 132.55 7.95 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 147.43 147.57 4.57 Favored Glycine 0 CA--C 1.538 1.469 0 C-N-CA 120.596 -0.811 . . . . 0.0 111.92 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -44.71 160.27 0.11 Allowed 'Trans proline' 0 N--CA 1.501 1.966 0 C-N-CA 122.194 1.929 . . . . 0.0 112.035 178.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -57.18 -44.7 41.22 Favored 'Trans proline' 0 N--CA 1.504 2.095 0 C-N-CA 122.704 2.269 . . . . 0.0 112.285 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -86.1 -2.13 58.04 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.071 0.462 . . . . 0.0 110.293 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.93 61.28 17.69 Favored Pre-proline 0 N--CA 1.462 0.168 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.496 178.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -81.29 145.95 15.39 Favored 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.706 2.271 . . . . 0.0 111.458 179.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -129.4 128.46 43.06 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -114.54 103.07 10.65 Favored 'General case' 0 CA--C 1.498 -1.029 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.963 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.9 mmm-85 -101.31 107.41 18.76 Favored 'General case' 0 C--N 1.316 -0.856 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.386 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 43.7 t -111.85 126.21 54.85 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.787 -179.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -106.36 152.98 22.87 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 p -121.14 120.4 62.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.279 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 52.1 m -98.22 120.44 38.64 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.913 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.497 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 6.3 t80 -144.06 137.35 27.53 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.264 -0.425 . . . . 0.0 109.988 -179.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.497 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 7.6 m 47.46 40.04 10.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.832 0.349 . . . . 0.0 110.754 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 66.02 31.72 80.31 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 111.598 -0.601 . . . . 0.0 111.598 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -135.83 126.01 26.31 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.746 0.307 . . . . 0.0 110.355 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 27.6 m -107.51 108.83 20.32 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.877 0.37 . . . . 0.0 110.852 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -93.31 141.92 27.9 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.744 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -142.94 144.23 32.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.593 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.5 p -84.11 162.19 20.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.634 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.7 p -93.3 -7.53 44.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.225 179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -116.96 152.58 34.27 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.364 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.699 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -103.73 132.48 49.94 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-O 121.85 0.833 . . . . 0.0 109.735 -179.671 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.406 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -87.48 149.42 46.58 Favored Pre-proline 0 C--N 1.303 -1.423 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.454 -179.855 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.12 -5.1 14.91 Favored 'Trans proline' 0 N--CA 1.494 1.515 0 C-N-CA 122.588 2.192 . . . . 0.0 112.704 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 51.6 m -135.09 150.95 50.32 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.875 0.369 . . . . 0.0 111.201 -178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.31 -61.73 2.16 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.734 -178.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.523 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 68.8 mttm -54.95 -34.44 63.27 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 120.792 0.33 . . . . 0.0 110.91 -178.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 15.2 t -55.57 -38.42 69.33 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.066 0.46 . . . . 0.0 109.849 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.59 -41.68 79.28 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.345 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -64.12 -43.67 94.58 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.764 0.316 . . . . 0.0 110.821 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.632 ' CD2' ' ND1' ' A' ' 3' ' ' HIS . 84.8 m-70 -67.38 -45.61 75.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.674 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.0 -40.37 87.33 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.2 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.01 -45.37 93.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.839 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.41 ' O ' HG23 ' A' ' 68' ' ' VAL . . . -58.95 -38.19 78.48 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.527 -179.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -57.83 -48.45 79.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.789 179.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.6 mt -57.87 -48.88 82.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.166 -178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.03 -43.47 92.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.639 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 64' ' ' ALA . 20.8 t -59.14 -42.58 87.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 109.994 -179.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.99 -29.86 71.15 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.929 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.8 t -65.43 -43.36 90.71 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 120.876 0.369 . . . . 0.0 111.285 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 53.4 mt -65.94 -31.17 71.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.591 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 75.6 p . . . . . 0 C--O 1.219 -0.521 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.503 179.878 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.0 mtp . . . . . 0 N--CA 1.489 1.493 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.523 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 25.2 p-10 -92.36 -0.91 57.34 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.687 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.62 ' CD2' ' CE1' ' A' ' 61' ' ' HIS . 22.6 t-160 -145.35 30.89 1.11 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.065 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.403 ' H ' HG22 ' A' ' 4' ' ' VAL . 21.9 m -92.96 -16.97 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.776 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -61.43 -42.79 99.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.8 0.334 . . . . 0.0 111.063 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -59.33 -39.6 83.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.412 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.28 -24.34 59.36 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -77.28 -50.1 13.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.149 0.5 . . . . 0.0 110.859 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 31.5 tp -63.27 -41.79 99.06 Favored 'General case' 0 CA--C 1.507 -0.693 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.328 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.0 tp-100 -60.79 -41.3 95.3 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 120.086 -0.645 . . . . 0.0 110.803 -178.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.67 -37.3 86.12 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.426 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 81.0 t80 -61.35 -49.87 75.21 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.898 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.488 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.96 -49.39 75.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.953 0.406 . . . . 0.0 110.293 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.2 tp -62.78 -44.25 96.66 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.581 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -64.17 -37.32 87.05 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.698 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 59.3 m80 -94.83 -2.36 50.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.7 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 13' ' ' ALA . 55.2 t-20 59.29 66.57 1.01 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.715 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 71.5 mt -124.49 149.96 46.29 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.459 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -46.06 134.58 8.16 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.906 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.49 HD23 ' H ' ' A' ' 20' ' ' LEU . 0.2 OUTLIER -46.91 146.73 2.57 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.745 -178.844 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.36 154.66 45.93 Favored 'Trans proline' 0 N--CA 1.496 1.631 0 C-N-CA 122.758 2.306 . . . . 0.0 112.354 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.0 t -129.9 130.38 66.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.379 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 31.7 m-85 -107.42 152.34 24.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.857 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.438 ' HB3' ' CG ' ' A' ' 39' ' ' ASN . . . -119.68 134.87 55.06 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -115.59 125.68 53.25 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.983 0.42 . . . . 0.0 111.516 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -129.83 127.75 40.91 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.515 178.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 -129.47 117.82 21.13 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 120.657 0.265 . . . . 0.0 110.314 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -157.17 130.75 8.03 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 150.65 139.77 3.08 Favored Glycine 0 CA--C 1.533 1.178 0 C-N-CA 120.506 -0.854 . . . . 0.0 111.204 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_exo -43.79 162.93 0.05 OUTLIER 'Trans proline' 0 C--N 1.314 -1.287 0 C-N-CA 122.243 1.962 . . . . 0.0 112.542 179.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -52.08 -48.95 19.04 Favored 'Trans proline' 0 N--CA 1.497 1.716 0 C-N-CA 122.414 2.076 . . . . 0.0 112.543 179.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -86.77 0.48 54.68 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.593 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.12 61.55 21.59 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.025 179.02 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -82.68 144.47 12.48 Favored 'Trans proline' 0 C--N 1.308 -1.574 0 C-N-CA 122.748 2.298 . . . . 0.0 111.893 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 87.5 mtm180 -133.57 130.4 38.36 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -113.78 104.13 11.9 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.461 -0.496 . . . . 0.0 111.144 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.584 ' NH2' ' NE2' ' A' ' 48' ' ' GLN . 81.1 mtp85 -106.34 105.46 15.5 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 47.1 m -119.15 144.0 46.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.067 0.461 . . . . 0.0 110.203 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.438 ' CG ' ' HB3' ' A' ' 24' ' ' ALA . 13.6 p30 -124.3 160.1 28.78 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.452 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.427 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.1 p -120.28 120.69 63.63 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.253 0 CA-C-O 121.119 0.485 . . . . 0.0 110.202 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.407 ' OG1' HG22 ' A' ' 46' ' ' THR . 66.7 m -95.9 116.96 29.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.152 179.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -139.34 137.36 35.71 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.97 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.497 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 43.1 t 48.04 32.3 2.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.814 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 73.86 33.52 57.5 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -137.87 122.86 19.03 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.407 HG22 ' OG1' ' A' ' 41' ' ' THR . 18.7 p -105.02 109.56 21.61 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.05 -179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -95.12 141.42 28.77 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.084 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.584 ' NE2' ' NH2' ' A' ' 37' ' ' ARG . 58.0 tt0 -148.31 144.51 27.63 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.856 0.36 . . . . 0.0 110.546 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.3 p -84.3 163.13 19.81 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.631 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.0 m -89.76 -7.34 54.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.648 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -112.28 148.94 33.11 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.128 0.49 . . . . 0.0 109.929 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.685 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -101.61 131.95 47.54 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.481 -179.615 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.503 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -86.43 148.29 46.45 Favored Pre-proline 0 C--N 1.307 -1.257 0 CA-C-N 114.076 -1.42 . . . . 0.0 111.131 -179.489 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -77.42 -8.38 17.25 Favored 'Trans proline' 0 N--CA 1.495 1.584 0 C-N-CA 122.674 2.25 . . . . 0.0 111.984 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 41.5 m -129.07 148.4 51.02 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.772 -179.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 56' ' ' LEU . 1.4 tt -63.83 -61.9 1.99 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.159 -178.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -54.49 -34.21 61.21 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 121.028 -0.269 . . . . 0.0 110.741 -178.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.5 t -55.89 -34.03 65.17 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.104 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.87 -41.98 67.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.158 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -63.99 -41.68 97.43 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.663 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.62 ' CE1' ' CD2' ' A' ' 3' ' ' HIS . 5.2 m-70 -66.99 -47.76 70.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.811 0.339 . . . . 0.0 110.83 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.51 -38.29 84.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.606 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.8 -48.37 82.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.597 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.06 -36.81 80.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.366 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -58.0 -47.43 83.05 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 97.1 mt -59.69 -45.92 93.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.106 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.32 -43.29 86.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.087 0.47 . . . . 0.0 110.41 179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.1 t -59.56 -42.3 87.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.216 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.05 -27.45 69.11 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.969 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.4 t -67.08 -42.08 85.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.557 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 52.5 mt -66.19 -30.25 70.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.643 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.221 -0.432 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.719 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.3 mtt . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 42.2 -111.1 0.15 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.557 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -147.46 110.02 4.64 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.287 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.4 m -98.24 -15.52 7.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 CA-C-O 120.58 0.229 . . . . 0.0 110.936 179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.639 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 4.7 m-85 -58.14 -42.97 87.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.862 -178.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.412 ' NZ ' ' OE1' ' A' ' 60' ' ' GLU . 98.8 mttt -59.45 -40.37 86.62 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.213 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -69.99 -28.15 72.13 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.202 -0.759 . . . . 0.0 111.202 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -77.28 -50.68 12.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.103 0.478 . . . . 0.0 111.357 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 56.1 tp -62.38 -41.51 98.7 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.259 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -62.53 -39.62 94.16 Favored 'General case' 0 C--N 1.31 -1.134 0 C-N-CA 119.641 -0.824 . . . . 0.0 110.035 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.42 -39.39 77.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.82 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -61.78 -52.61 63.52 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.031 -179.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.87 -47.86 79.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.021 0.439 . . . . 0.0 110.304 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.8 tp -62.56 -44.41 96.39 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.593 -179.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -65.03 -40.89 95.49 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.597 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.525 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 64.8 t-80 -87.03 -2.8 58.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.77 -179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 58.72 65.56 1.22 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.888 0.375 . . . . 0.0 110.185 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.8 mt -128.67 147.43 50.74 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.498 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -41.7 133.41 2.73 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.568 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.5 mt -48.13 144.39 5.99 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.96 -179.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -70.6 153.94 64.74 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.317 2.012 . . . . 0.0 111.952 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.5 t -131.43 130.54 62.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.636 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -105.22 153.11 22.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.447 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.475 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -119.57 140.81 49.96 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.371 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -118.05 126.69 52.77 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.787 0.327 . . . . 0.0 111.205 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -136.5 131.16 33.59 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 178.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.9 ttp85 -130.24 119.49 22.98 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -157.83 132.07 8.22 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 150.57 140.64 3.23 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 120.23 -0.986 . . . . 0.0 111.225 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -42.92 166.64 0.03 OUTLIER 'Trans proline' 0 N--CA 1.488 1.156 0 C-N-CA 122.079 1.853 . . . . 0.0 112.853 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -55.28 -50.43 13.0 Favored 'Trans proline' 0 N--CA 1.502 2.015 0 C-N-CA 122.522 2.148 . . . . 0.0 112.941 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -87.13 3.15 47.48 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.489 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.16 60.24 16.97 Favored Pre-proline 0 CA--C 1.531 0.212 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.044 178.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -80.12 144.26 16.55 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.608 2.205 . . . . 0.0 111.73 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.609 ' NH1' ' CD1' ' A' ' 52' ' ' PHE . 96.5 mtt-85 -133.36 131.39 40.02 Favored 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 109.654 -0.498 . . . . 0.0 109.654 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -114.36 103.96 11.59 Favored 'General case' 0 CA--C 1.508 -0.639 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.85 179.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -99.97 106.61 18.43 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.646 -0.422 . . . . 0.0 109.909 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.475 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 45.9 t -111.02 123.05 49.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.505 -179.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -106.47 150.55 25.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.002 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.483 ' O ' HG13 ' A' ' 40' ' ' VAL . 5.5 p -119.76 119.74 61.23 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.201 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 96.5 m -93.96 122.12 36.14 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.375 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -143.0 131.99 22.94 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.473 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 49.9 t 46.14 46.7 13.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.933 0.397 . . . . 0.0 110.81 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.09 33.2 84.97 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.281 -0.727 . . . . 0.0 111.281 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.423 ' CG ' ' CE1' ' A' ' 47' ' ' PHE . 68.1 tp60 -139.28 125.17 19.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.826 0.346 . . . . 0.0 110.203 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.8 p -105.41 109.95 22.11 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.233 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.423 ' CE1' ' CG ' ' A' ' 45' ' ' GLN . 51.4 m-85 -90.77 140.88 29.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.165 -0.47 . . . . 0.0 109.782 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -148.51 149.4 31.58 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.175 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 42.5 t -88.69 162.12 16.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.642 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 96.4 p -87.67 -6.8 58.07 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.716 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -123.1 143.45 49.97 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.211 0.529 . . . . 0.0 110.781 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.609 ' CD1' ' NH1' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -91.7 142.62 27.41 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.891 -179.272 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.501 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -94.22 147.59 33.63 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 114.659 -1.155 . . . . 0.0 111.185 -179.568 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -76.15 -4.71 15.45 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 C-N-CA 122.69 2.26 . . . . 0.0 112.496 179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.33 155.37 50.71 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.225 0.536 . . . . 0.0 111.132 -179.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.03 -64.04 0.94 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.371 -178.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -54.64 -34.23 61.82 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 120.659 0.266 . . . . 0.0 110.575 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.6 t -55.79 -36.44 67.39 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.573 -0.451 . . . . 0.0 109.803 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.482 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -70.84 -41.19 71.79 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.5 -179.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.412 ' OE1' ' NZ ' ' A' ' 6' ' ' LYS . 98.7 mt-10 -62.15 -43.06 99.68 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.874 -179.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.639 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -62.7 -51.38 67.41 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.208 0.528 . . . . 0.0 110.311 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.57 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -64.84 -35.24 80.47 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.176 -178.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.79 -49.39 77.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.594 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.7 -32.52 71.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.612 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -55.22 -45.75 75.96 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.619 0.247 . . . . 0.0 111.151 -179.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.3 pt -72.12 -37.45 59.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.62 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.85 -50.44 56.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.001 0.429 . . . . 0.0 111.961 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.96 -36.81 78.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.67 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.61 -26.96 68.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.755 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 37.5 m -78.49 -25.29 45.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.936 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.8 mt -119.43 29.01 7.85 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.28 0.562 . . . . 0.0 110.092 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 42.2 m . . . . . 0 C--N 1.322 -0.613 0 CA-C-O 117.904 -1.046 . . . . 0.0 110.534 179.309 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.6 mtm . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -69.04 140.75 54.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.443 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.516 ' O ' ' CG ' ' A' ' 3' ' ' HIS . 53.5 p-80 -77.71 69.99 4.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.918 -179.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.1 m -105.38 -13.93 9.09 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.121 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.924 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -60.13 -42.17 94.22 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.826 0.346 . . . . 0.0 110.867 -178.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.649 ' HZ3' ' CD2' ' A' ' 61' ' ' HIS . 64.3 mttp -60.87 -41.25 95.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.211 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.37 -31.62 81.47 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 110.736 -0.946 . . . . 0.0 110.736 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -75.94 -48.53 20.84 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.709 0.29 . . . . 0.0 111.459 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.431 HD23 ' OH ' ' A' ' 23' ' ' TYR . 48.2 tp -62.99 -39.42 94.66 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.305 -179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -63.06 -41.66 99.5 Favored 'General case' 0 N--CA 1.437 -1.105 0 C-N-CA 119.655 -0.818 . . . . 0.0 110.285 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.64 -40.25 84.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.895 179.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.42 ' O ' ' N ' ' A' ' 16' ' ' HIS . 53.8 t80 -61.98 -51.28 68.69 Favored 'General case' 0 N--CA 1.462 0.148 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.805 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.98 -40.4 73.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.433 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 39.1 tp -63.17 -46.21 88.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.529 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -79.61 -20.52 46.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.975 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.42 ' N ' ' O ' ' A' ' 12' ' ' TYR . 38.8 t-80 -87.15 -13.55 43.74 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.693 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 49.62 64.88 1.58 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.249 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.551 HD21 ' CZ ' ' A' ' 42' ' ' PHE . 0.9 OUTLIER -139.79 169.16 18.22 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.982 0.42 . . . . 0.0 110.452 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -46.36 126.08 7.54 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.739 178.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.539 HD23 ' H ' ' A' ' 20' ' ' LEU . 0.2 OUTLIER -45.81 151.42 0.85 Allowed Pre-proline 0 CA--C 1.539 0.542 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.669 -178.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.18 151.03 72.39 Favored 'Trans proline' 0 N--CA 1.499 1.802 0 C-N-CA 122.42 2.08 . . . . 0.0 112.215 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.4 t -133.51 131.08 57.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.227 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.431 ' OH ' HD23 ' A' ' 9' ' ' LEU . 32.2 m-85 -106.14 152.13 23.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.885 179.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.43 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -114.56 146.01 41.27 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.1 178.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -124.42 124.56 42.6 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.788 0.328 . . . . 0.0 111.636 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -132.75 129.07 38.16 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 71.2 ttt-85 -134.3 120.36 19.84 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.355 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -162.18 135.1 5.96 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.496 -0.481 . . . . 0.0 109.843 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 145.02 163.42 10.08 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 120.316 -0.945 . . . . 0.0 112.185 178.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -54.03 159.82 6.96 Favored 'Trans proline' 0 N--CA 1.504 2.116 0 C-N-CA 122.571 2.181 . . . . 0.0 111.894 177.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -60.4 -42.39 41.68 Favored 'Trans proline' 0 N--CA 1.505 2.202 0 C-N-CA 122.863 2.375 . . . . 0.0 113.002 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -87.86 -2.05 58.36 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.206 0.527 . . . . 0.0 110.168 -179.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.79 62.28 17.17 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.583 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -78.42 142.62 18.81 Favored 'Trans proline' 0 C--N 1.304 -1.771 0 C-N-CA 122.622 2.215 . . . . 0.0 111.626 179.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -118.99 121.4 39.83 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -114.56 102.39 10.01 Favored 'General case' 0 CA--C 1.505 -0.787 0 C-N-CA 119.647 -0.821 . . . . 0.0 111.53 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.5 mtp85 -101.08 107.82 19.35 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.789 179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.43 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 48.4 t -109.53 122.35 47.24 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.634 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.508 ' OD1' ' N ' ' A' ' 40' ' ' VAL . 40.8 t-20 -103.61 150.74 23.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.701 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.508 ' N ' ' OD1' ' A' ' 39' ' ' ASN . 4.0 p -122.42 119.6 58.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.866 0.365 . . . . 0.0 110.417 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 98.3 m -96.47 121.33 38.16 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.072 179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.551 ' CZ ' HD21 ' A' ' 18' ' ' LEU . 6.1 t80 -144.19 136.0 26.09 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.422 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 42.7 t 45.82 44.65 11.07 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.411 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 62.54 30.76 77.48 Favored Glycine 0 CA--C 1.526 0.776 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.921 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -135.48 131.06 35.64 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 122.691 -0.299 . . . . 0.0 110.314 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 54.4 p -108.8 107.4 17.81 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.047 0.451 . . . . 0.0 111.101 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -92.7 141.56 28.34 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.111 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -152.23 147.7 26.7 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.749 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.4 p -85.79 166.14 16.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.818 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 85.3 p -92.64 -6.96 48.28 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.626 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -122.7 129.51 51.89 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.006 0.432 . . . . 0.0 110.898 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -79.2 148.64 32.19 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.686 0.755 . . . . 0.0 110.17 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.485 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -96.22 150.33 37.05 Favored Pre-proline 0 C--N 1.313 -0.982 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.857 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -77.6 -4.41 14.57 Favored 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 122.421 2.081 . . . . 0.0 112.712 178.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.8 152.42 51.74 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 120.961 0.41 . . . . 0.0 110.851 -179.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.43 -62.44 1.53 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.762 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -56.11 -35.97 67.68 Favored 'General case' 0 CA--C 1.52 -0.198 0 O-C-N 122.137 -0.352 . . . . 0.0 110.816 -177.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 38.5 m -54.68 -36.12 64.3 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.451 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -69.1 -43.21 74.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.454 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.54 -41.86 97.97 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.463 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.649 ' CD2' ' HZ3' ' A' ' 6' ' ' LYS . 32.4 m170 -62.73 -48.81 77.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.766 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.05 -35.51 80.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.827 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.47 -48.88 79.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.478 -179.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.86 -33.49 75.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -54.79 -46.91 74.51 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.656 0.265 . . . . 0.0 111.084 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.1 pt -73.97 -33.11 35.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.872 0.368 . . . . 0.0 110.663 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.435 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -67.33 -50.26 60.76 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.831 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.3 p -65.4 -30.11 49.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.527 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.41 -33.86 73.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.118 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.435 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 78.0 p -67.07 -39.67 86.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.019 0.438 . . . . 0.0 110.576 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 56.6 mt -66.79 -31.83 72.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.621 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 84.8 m . . . . . 0 C--O 1.219 -0.513 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.495 179.945 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.459 ' O ' ' N ' ' A' ' 3' ' ' HIS . 97.3 mmm . . . . . 0 N--CA 1.489 1.477 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 41.76 -94.3 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.9 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.551 ' O ' ' CG ' ' A' ' 3' ' ' HIS . 12.2 t-80 52.49 50.25 18.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.937 179.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -117.96 -44.64 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-O 120.966 0.412 . . . . 0.0 110.635 -179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.628 ' N ' ' CD1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -61.17 -23.83 65.85 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.859 -179.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -62.39 -42.39 99.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.154 0.502 . . . . 0.0 110.322 -179.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.72 -23.55 76.44 Favored Glycine 0 CA--C 1.525 0.691 0 N-CA-C 111.086 -0.806 . . . . 0.0 111.086 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -78.04 -50.35 12.25 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.83 0.348 . . . . 0.0 111.179 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 38.5 tp -62.74 -42.59 99.74 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.14 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.9 tp-100 -64.45 -42.58 95.88 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.138 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.91 -37.27 78.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.824 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -61.52 -49.83 75.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.679 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.473 ' HB2' ' HZ ' ' A' ' 42' ' ' PHE . . . -58.6 -47.3 84.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.934 0.397 . . . . 0.0 110.246 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.4 tp -62.15 -46.37 89.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.517 -179.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -65.76 -38.7 89.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.976 0.417 . . . . 0.0 110.487 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.502 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 61.6 t-80 -87.51 -0.58 57.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.607 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 56.5 65.1 1.5 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.642 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 81.6 mt -127.71 151.7 48.65 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.678 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -46.86 128.0 10.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.131 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.573 ' N ' HD12 ' A' ' 20' ' ' LEU . 10.0 mp -46.95 147.95 2.08 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.473 -178.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.06 152.57 62.7 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.369 2.046 . . . . 0.0 112.214 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 68.7 t -130.22 130.2 65.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.517 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -105.37 152.62 22.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.596 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.494 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -116.56 145.1 43.6 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.476 178.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -123.29 124.62 43.39 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.837 0.351 . . . . 0.0 111.234 -179.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -134.14 134.75 42.55 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.805 178.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 -135.35 121.34 19.92 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.687 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -153.95 125.77 7.71 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 145.74 154.5 6.18 Favored Glycine 0 CA--C 1.525 0.681 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 179.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.667 ' HG2' ' HB3' ' A' ' 33' ' ' ALA . 55.5 Cg_endo -68.13 166.38 25.19 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.109 1.873 . . . . 0.0 111.846 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.87 -43.78 53.62 Favored 'Trans proline' 0 N--CA 1.503 2.047 0 C-N-CA 122.395 2.063 . . . . 0.0 113.059 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -78.97 -13.28 59.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.639 0.257 . . . . 0.0 111.129 -178.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.667 ' HB3' ' HG2' ' A' ' 30' ' ' PRO . . . -140.0 64.37 27.14 Favored Pre-proline 0 N--CA 1.467 0.409 0 CA-C-O 121.173 0.511 . . . . 0.0 110.807 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -82.07 141.5 11.79 Favored 'Trans proline' 0 C--N 1.312 -1.38 0 C-N-CA 122.462 2.108 . . . . 0.0 110.897 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -127.26 125.74 41.47 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -114.86 104.35 11.85 Favored 'General case' 0 CA--C 1.506 -0.737 0 C-N-CA 120.153 -0.619 . . . . 0.0 110.789 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -101.76 107.25 18.4 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.065 0.46 . . . . 0.0 110.599 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.494 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 50.9 t -109.55 124.25 50.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.967 -179.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -105.24 149.95 25.55 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.476 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.3 p -119.7 119.32 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 120.913 0.387 . . . . 0.0 110.025 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 96.4 m -95.67 121.93 37.9 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.12 179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.482 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 5.3 t80 -143.07 137.38 29.15 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.36 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.483 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 12.0 p 42.19 42.83 2.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.829 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.484 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 66.16 32.35 82.01 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.436 -0.666 . . . . 0.0 111.436 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.484 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 97.7 mm-40 -136.46 130.87 33.25 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.66 0.266 . . . . 0.0 110.357 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 61.8 p -110.04 107.59 17.51 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.221 -179.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.427 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 52.3 m-85 -94.14 141.06 28.97 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.966 179.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -154.26 148.03 25.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.481 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.6 p -85.31 168.21 14.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.464 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.9 p -93.83 -0.61 55.71 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.544 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -120.88 153.28 37.38 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.044 0.449 . . . . 0.0 110.344 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.686 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -103.94 134.69 46.81 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.813 -179.488 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.49 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -86.27 147.99 46.17 Favored Pre-proline 0 C--N 1.306 -1.318 0 CA-C-N 114.29 -1.323 . . . . 0.0 110.579 -179.695 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.41 -4.63 15.28 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.704 2.269 . . . . 0.0 112.433 179.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -136.09 154.73 50.92 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.079 0.466 . . . . 0.0 111.22 -179.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.17 -62.62 1.43 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.312 -178.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.41 ' O ' ' CD2' ' A' ' 61' ' ' HIS . 98.8 mttt -55.39 -34.46 64.37 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.756 0.312 . . . . 0.0 110.658 -178.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 39.4 m -54.48 -35.94 63.61 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.454 -0.498 . . . . 0.0 109.925 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.477 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -72.17 -43.71 64.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.408 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -63.76 -44.27 93.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.645 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.41 ' CD2' ' O ' ' A' ' 57' ' ' LYS . 89.3 m-70 -64.04 -49.19 73.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.627 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.93 -35.2 79.96 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.611 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.15 -41.43 83.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.261 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.28 -34.59 78.34 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.625 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -53.87 -47.58 70.91 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.508 0.194 . . . . 0.0 110.907 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.403 HG12 ' H ' ' A' ' 66' ' ' ILE . 25.8 pt -74.35 -27.93 22.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.583 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.58 -51.15 30.3 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.914 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.0 p -63.27 -30.67 50.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.425 -179.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.9 -35.1 76.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.862 0.363 . . . . 0.0 110.794 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.427 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 17.7 m -62.03 -42.94 99.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.668 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.1 mt -66.69 -30.21 70.4 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.627 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 74.1 m . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.601 179.991 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.6 mtp . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 -68.98 142.81 54.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.329 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.4 ' HE2' ' HD3' ' A' ' 57' ' ' LYS . 80.6 m-70 -94.91 80.71 3.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.328 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 33.2 m -82.1 -16.18 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.859 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.66 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 3.2 m-85 -59.31 -44.21 92.58 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.759 -178.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -58.45 -43.53 88.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.413 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -72.79 -24.38 76.18 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 69.7 tp60 -77.13 -48.77 16.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.946 0.403 . . . . 0.0 111.087 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.4 HD23 ' OH ' ' A' ' 23' ' ' TYR . 58.8 tp -61.75 -41.45 97.7 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.291 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -62.85 -40.82 98.64 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.743 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.98 -38.18 79.18 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.553 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.623 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 86.0 t80 -62.0 -51.75 66.78 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.665 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.511 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -58.19 -46.22 86.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.416 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.6 tp -62.26 -47.2 85.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.729 -179.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -66.19 -36.44 83.1 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.627 -179.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.623 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 61.8 m80 -92.05 -3.2 56.09 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.711 -179.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.511 ' N ' ' O ' ' A' ' 13' ' ' ALA . 97.4 m-20 56.76 66.01 1.27 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.698 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 70.1 mt -125.31 145.39 50.04 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.988 0.423 . . . . 0.0 110.48 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.644 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 1.3 pm0 -41.04 134.96 1.89 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.183 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.8 mt -47.31 143.37 5.17 Favored Pre-proline 0 C--N 1.321 -0.664 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.973 -179.006 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -73.06 153.41 52.07 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 122.37 2.047 . . . . 0.0 111.989 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.4 t -129.65 130.62 66.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.413 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.4 ' OH ' HD23 ' A' ' 9' ' ' LEU . 33.6 m-85 -107.02 153.01 23.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.393 -0.822 . . . . 0.0 110.718 179.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.504 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -115.47 146.39 41.7 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.326 178.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -123.97 124.16 41.98 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.062 0.458 . . . . 0.0 111.357 -179.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -134.86 129.34 34.27 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 76.0 ttt-85 -133.32 123.6 25.73 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.532 -179.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.537 ' OE2' ' NH2' ' A' ' 37' ' ' ARG . 14.4 pt-20 -157.71 128.21 6.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.936 0.398 . . . . 0.0 109.996 179.344 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 143.34 161.37 8.82 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 111.234 -0.746 . . . . 0.0 111.234 179.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.706 ' HG2' ' HB3' ' A' ' 33' ' ' ALA . 42.5 Cg_endo -68.83 163.2 38.27 Favored 'Trans proline' 0 C--N 1.306 -1.675 0 C-N-CA 122.405 2.07 . . . . 0.0 111.354 178.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.24 -37.73 97.05 Favored 'Trans proline' 0 C--N 1.308 -1.553 0 C-N-CA 122.992 2.462 . . . . 0.0 112.386 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -81.19 -14.74 57.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.845 0.355 . . . . 0.0 110.852 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.706 ' HB3' ' HG2' ' A' ' 30' ' ' PRO . . . -140.7 62.46 18.05 Favored Pre-proline 0 N--CA 1.47 0.549 0 CA-C-O 121.534 0.683 . . . . 0.0 110.961 179.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -78.27 143.14 19.59 Favored 'Trans proline' 0 C--N 1.302 -1.883 0 C-N-CA 122.115 1.877 . . . . 0.0 111.48 179.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 84.8 mtm-85 -124.32 122.24 37.17 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -114.23 104.05 11.7 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.949 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.537 ' NH2' ' OE2' ' A' ' 28' ' ' GLU . 87.7 mtm180 -102.87 105.84 16.3 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.504 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 52.6 t -109.21 124.55 51.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.398 -179.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -105.43 150.02 25.64 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.919 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.463 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.1 p -120.9 119.69 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 CA-C-O 121.036 0.446 . . . . 0.0 110.243 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 96.4 m -97.23 120.48 37.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.506 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.556 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 5.1 t80 -141.68 137.8 32.01 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.266 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.556 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 3.9 m 45.32 37.32 2.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.716 179.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.471 ' O ' ' NE2' ' A' ' 45' ' ' GLN . . . 69.68 32.62 70.84 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 111.25 -0.74 . . . . 0.0 111.25 179.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.471 ' NE2' ' O ' ' A' ' 44' ' ' GLY . 98.0 mm-40 -135.99 125.11 24.44 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 39.9 p -105.78 107.33 18.27 Favored 'General case' 0 N--CA 1.461 0.121 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.105 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -92.5 141.07 28.92 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.019 179.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 55.1 tt0 -150.49 152.3 34.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.325 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 73.2 m -95.42 160.56 14.47 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.532 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.8 m -87.2 -7.1 58.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.713 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.537 ' N ' ' OE1' ' A' ' 51' ' ' GLU . 56.3 mp0 -115.26 151.86 33.75 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.271 0.558 . . . . 0.0 110.237 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.691 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -103.53 133.7 48.12 Favored 'General case' 0 CA--C 1.505 -0.75 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.01 -179.219 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.46 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -86.19 147.16 44.28 Favored Pre-proline 0 C--N 1.308 -1.236 0 CA-C-N 114.118 -1.401 . . . . 0.0 110.831 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.84 -5.13 16.08 Favored 'Trans proline' 0 N--CA 1.498 1.756 0 C-N-CA 122.792 2.328 . . . . 0.0 112.581 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.07 155.42 50.77 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.141 0.496 . . . . 0.0 111.002 -179.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.68 -64.68 0.81 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.569 -178.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.4 ' HD3' ' HE2' ' A' ' 3' ' ' HIS . 15.6 ptpt -53.11 -33.45 52.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.894 0.378 . . . . 0.0 110.657 -178.009 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.2 m -57.26 -35.05 69.26 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.047 179.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.3 -41.22 70.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.27 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -62.31 -40.25 95.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.38 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.66 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -64.66 -51.17 63.95 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.204 0.526 . . . . 0.0 110.501 179.74 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.549 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -65.71 -35.73 81.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.595 -178.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.91 -48.91 79.78 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.492 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.36 -32.91 73.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.733 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -54.93 -45.86 74.88 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.851 0.357 . . . . 0.0 111.34 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.2 pt -73.74 -33.51 38.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.986 0.422 . . . . 0.0 110.548 179.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.83 -50.0 47.02 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.125 0.488 . . . . 0.0 111.64 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.2 p -64.56 -31.11 52.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.407 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.429 ' O ' ' OG1' ' A' ' 72' ' ' THR . . . -69.51 -30.2 68.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.722 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.1 t -68.45 -42.64 78.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.805 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 53.3 mt -65.59 -30.56 71.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.715 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.429 ' OG1' ' O ' ' A' ' 69' ' ' ALA . 21.4 p . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 117.976 -1.012 . . . . 0.0 110.845 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.535 ' SD ' ' N ' ' A' ' 1' ' ' MET . 2.3 mpt? . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -68.61 142.43 55.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.487 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.6 p-80 -151.53 35.52 0.56 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.516 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.4 m -85.68 -17.09 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.399 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -58.45 -44.15 89.12 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 120.805 0.336 . . . . 0.0 110.722 -179.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -58.98 -37.05 75.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.527 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.52 -26.26 59.47 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 87.1 mm-40 -78.66 -50.77 10.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.985 0.421 . . . . 0.0 111.091 179.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 35.7 tp -61.44 -42.78 99.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.582 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -63.15 -40.67 98.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.814 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.86 -37.35 79.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.385 179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -61.74 -50.01 74.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.769 -179.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.467 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.91 -47.71 79.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.942 0.401 . . . . 0.0 110.584 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.3 tp -61.6 -45.4 94.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.548 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -66.2 -41.81 89.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.649 -179.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.474 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 66.3 t-80 -86.52 -5.05 59.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.565 -179.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.467 ' N ' ' O ' ' A' ' 13' ' ' ALA . 44.4 t-20 60.49 65.83 1.01 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.584 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.7 mt -125.34 147.83 48.98 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.868 0.366 . . . . 0.0 110.393 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -45.41 134.37 6.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.033 0.444 . . . . 0.0 110.272 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.5 mt -46.06 143.85 3.27 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.739 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -73.0 155.44 52.8 Favored 'Trans proline' 0 C--N 1.309 -1.531 0 C-N-CA 122.733 2.289 . . . . 0.0 112.086 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.4 t -129.53 132.38 66.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.466 179.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -108.88 153.59 23.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.692 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.51 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -116.19 141.17 48.49 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.823 178.322 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -119.76 125.53 48.84 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.026 0.441 . . . . 0.0 110.966 -179.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -135.09 125.86 27.26 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.769 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -130.2 119.79 23.5 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.954 0.407 . . . . 0.0 110.388 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -159.57 133.05 7.13 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.184 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 146.04 149.86 5.08 Favored Glycine 0 CA--C 1.531 1.033 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_exo -45.85 159.92 0.2 Allowed 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.661 2.241 . . . . 0.0 111.722 178.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -57.12 -44.17 46.39 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.743 2.295 . . . . 0.0 112.095 179.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.48 ' ND1' ' O ' ' A' ' 32' ' ' HIS . 64.1 t-80 -87.16 -0.61 56.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.203 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -141.13 61.65 14.65 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.917 178.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -81.17 145.9 15.55 Favored 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.776 2.317 . . . . 0.0 111.94 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -128.61 127.74 42.84 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.184 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -114.11 103.89 11.57 Favored 'General case' 0 C--O 1.216 -0.706 0 C-N-CA 120.338 -0.545 . . . . 0.0 111.162 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.669 HH21 ' NE2' ' A' ' 48' ' ' GLN . 79.5 mtp85 -104.94 104.95 14.8 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.51 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 53.7 t -110.08 128.3 55.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.42 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -108.29 152.36 24.73 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.128 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.4 HG13 ' O ' ' A' ' 40' ' ' VAL . 2.7 p -121.06 120.46 62.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.074 0.464 . . . . 0.0 110.285 -179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 54.1 m -98.85 119.31 37.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.554 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -143.05 136.24 28.17 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.369 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.47 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 42.6 t 52.21 33.63 12.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.607 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 70.33 33.9 68.66 Favored Glycine 0 CA--C 1.522 0.488 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -139.09 125.4 20.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.836 0.35 . . . . 0.0 110.338 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 33.1 m -105.48 109.79 21.89 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.046 -179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -95.54 141.15 29.4 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.847 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.669 ' NE2' HH21 ' A' ' 37' ' ' ARG . 58.9 tt0 -144.58 147.96 33.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.933 0.397 . . . . 0.0 110.42 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.423 ' OG ' ' O ' ' A' ' 51' ' ' GLU . 9.3 p -84.63 161.83 19.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.523 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 91.5 p -88.61 -6.75 57.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.554 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.423 ' O ' ' OG ' ' A' ' 49' ' ' SER . 98.8 mt-10 -122.5 157.05 32.85 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.083 0.468 . . . . 0.0 110.355 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.69 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -105.01 139.22 40.02 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.613 0.721 . . . . 0.0 110.036 -179.271 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.466 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -91.4 147.77 36.12 Favored Pre-proline 0 C--N 1.308 -1.198 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.75 -179.668 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.81 -5.3 16.27 Favored 'Trans proline' 0 C--N 1.312 -1.388 0 C-N-CA 122.838 2.359 . . . . 0.0 112.4 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.447 HG22 ' N ' ' A' ' 56' ' ' LEU . 44.1 m -132.61 155.78 48.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.266 0.555 . . . . 0.0 110.729 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.447 ' N ' HG22 ' A' ' 55' ' ' THR . 0.9 OUTLIER -69.86 -64.92 0.79 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.122 -178.676 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -52.02 -37.26 52.78 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.587 -177.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.433 ' OG ' ' O ' ' A' ' 55' ' ' THR . 78.0 p -55.0 -33.08 62.29 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 123.429 0.455 . . . . 0.0 110.382 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.47 -40.9 66.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.823 0.344 . . . . 0.0 110.925 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -64.47 -40.4 95.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.383 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -68.17 -46.08 71.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.752 -179.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.92 -39.64 83.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.848 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.19 -48.95 79.56 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.728 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.32 -36.79 78.73 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.404 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -58.06 -47.7 82.36 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 86.3 mt -58.15 -47.32 87.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.318 -179.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.76 -44.94 76.31 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.587 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.5 t -58.54 -42.5 84.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.048 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.99 -25.97 68.37 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.539 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 6.3 t -67.49 -42.67 82.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.633 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 50.6 mt -68.42 -29.97 68.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.504 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.0 m . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.051 -0.976 . . . . 0.0 110.592 -179.74 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 ptt? . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.438 ' OD1' ' O ' ' A' ' 2' ' ' ASP . 44.4 p30 -64.13 144.85 56.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.465 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -139.12 -95.84 0.17 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.287 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.6 m -113.01 -21.91 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-N 116.638 -0.255 . . . . 0.0 110.895 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.651 ' CE2' ' ND1' ' A' ' 61' ' ' HIS . 17.6 m-85 -43.12 -64.79 0.57 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.88 0.371 . . . . 0.0 111.243 -179.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -50.83 -36.57 38.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.577 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -66.62 -36.69 91.72 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.916 -0.873 . . . . 0.0 110.916 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 66.8 tp60 -77.85 -49.2 14.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.988 0.423 . . . . 0.0 111.241 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 39.1 tp -60.06 -41.96 93.46 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.189 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -63.82 -41.93 97.76 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.912 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.45 -37.3 77.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.635 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.622 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 92.0 t80 -61.36 -53.56 55.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.982 -179.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.436 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.47 -50.53 71.48 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.115 0.483 . . . . 0.0 110.653 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.52 -43.52 98.62 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.137 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -65.32 -39.26 92.21 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.584 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.622 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 60.3 m80 -89.72 -4.63 57.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.548 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.436 ' N ' ' O ' ' A' ' 13' ' ' ALA . 62.8 t30 62.36 67.13 0.74 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.521 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 82.3 mt -129.17 147.65 51.04 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 120.872 0.368 . . . . 0.0 110.642 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -44.18 137.52 3.41 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.192 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.9 mt -50.23 144.1 11.93 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.073 -179.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -70.64 151.53 64.13 Favored 'Trans proline' 0 C--N 1.312 -1.344 0 C-N-CA 122.322 2.015 . . . . 0.0 111.881 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 68.1 t -127.7 130.47 70.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.118 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -105.28 153.18 21.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.67 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.456 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -118.0 143.86 46.04 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.416 178.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -120.48 127.35 52.14 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.832 0.349 . . . . 0.0 111.207 -179.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -137.85 130.49 29.67 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.794 178.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -130.62 120.55 24.13 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.811 0.338 . . . . 0.0 110.452 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -158.76 132.51 7.57 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.203 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 148.79 143.71 3.83 Favored Glycine 0 CA--C 1.531 1.055 0 C-N-CA 120.6 -0.81 . . . . 0.0 111.458 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -44.1 165.5 0.04 OUTLIER 'Trans proline' 0 C--N 1.317 -1.124 0 C-N-CA 122.182 1.921 . . . . 0.0 112.431 179.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -54.22 -51.63 10.16 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.455 2.103 . . . . 0.0 112.643 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -86.07 4.27 38.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.465 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.36 61.32 19.7 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.922 179.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -81.87 142.74 12.74 Favored 'Trans proline' 0 C--N 1.309 -1.539 0 C-N-CA 122.602 2.201 . . . . 0.0 111.992 178.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 -131.39 129.64 41.56 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 179.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -114.07 103.4 11.09 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.167 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 90.9 mtm180 -99.73 106.48 18.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.15 0.5 . . . . 0.0 109.867 -179.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.456 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 45.0 t -110.63 122.29 47.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.358 -179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -105.24 152.78 22.45 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.839 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.469 ' O ' HG13 ' A' ' 40' ' ' VAL . 5.0 p -121.48 120.1 60.89 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.282 0 CA-C-O 121.111 0.482 . . . . 0.0 110.246 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 94.8 m -95.18 121.69 37.08 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.107 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.42 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.1 t80 -140.73 136.25 32.36 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.803 0.335 . . . . 0.0 110.441 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 14.2 m 43.94 32.06 0.58 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.896 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.02 33.82 44.19 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.42 ' N ' ' O ' ' A' ' 42' ' ' PHE . 86.5 mt-30 -136.69 122.97 20.56 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 29.8 p -103.32 108.23 19.38 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.895 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -90.97 140.28 29.98 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.768 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -143.12 144.64 32.3 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.426 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 39.3 t -87.4 159.97 18.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.493 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 86.4 p -89.7 -5.82 56.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.682 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -117.81 153.26 33.78 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.18 0.514 . . . . 0.0 110.052 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.67 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -103.46 133.21 48.89 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-O 121.856 0.836 . . . . 0.0 109.917 -179.289 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.428 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.4 OUTLIER -87.64 145.93 38.18 Favored Pre-proline 0 C--N 1.311 -1.099 0 CA-C-N 114.045 -1.434 . . . . 0.0 110.748 179.879 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -76.38 -5.46 16.18 Favored 'Trans proline' 0 N--CA 1.496 1.623 0 C-N-CA 122.735 2.29 . . . . 0.0 112.433 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.1 p -136.21 155.89 49.47 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.027 0.441 . . . . 0.0 110.9 -179.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.15 -64.18 0.91 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.108 -178.656 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -52.7 -34.16 50.88 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 120.875 -0.33 . . . . 0.0 110.536 -177.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.6 m -56.48 -36.02 68.64 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.274 179.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.42 -38.4 71.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.03 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.33 -43.94 96.35 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.526 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.651 ' ND1' ' CE2' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -61.71 -50.23 73.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.171 0.51 . . . . 0.0 110.588 179.826 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.58 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -66.82 -36.06 81.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.632 -179.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.72 -47.95 82.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.685 -179.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.415 ' O ' HG23 ' A' ' 68' ' ' VAL . . . -68.39 -32.51 72.62 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.594 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -58.79 -53.89 53.3 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.07 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.41 HG13 ' N ' ' A' ' 67' ' ' ALA . 13.6 pt -58.6 -44.6 89.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.44 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.41 ' N ' HG13 ' A' ' 66' ' ' ILE . . . -67.7 -45.03 76.3 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.984 0.421 . . . . 0.0 110.402 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 64' ' ' ALA . 16.1 t -60.35 -42.56 91.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.65 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.08 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.2 -27.45 68.99 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.458 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.3 m -71.43 -33.86 69.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.514 179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 11.2 mt -112.92 29.51 7.91 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.149 0.5 . . . . 0.0 109.787 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 12.3 m . . . . . 0 C--N 1.322 -0.619 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.435 179.293 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.6 ptp . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 92.0 m-20 -67.68 139.64 56.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.615 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.508 ' O ' ' CD2' ' A' ' 3' ' ' HIS . 52.3 p-80 -75.48 65.37 1.72 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.722 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.8 m -111.8 -22.73 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-O 120.7 0.286 . . . . 0.0 110.709 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -60.66 -40.97 94.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.878 0.37 . . . . 0.0 110.607 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -58.74 -40.5 84.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.544 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -70.77 -25.44 75.72 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 96.4 mm-40 -77.35 -48.62 16.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.193 0.52 . . . . 0.0 111.297 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.445 HD23 ' OH ' ' A' ' 23' ' ' TYR . 44.7 tp -62.55 -42.08 99.31 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.367 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -64.07 -42.25 97.06 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.724 -179.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.03 -36.82 78.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.374 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.605 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 91.2 t80 -61.73 -51.07 69.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.794 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.506 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -57.58 -48.02 80.53 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.01 0.433 . . . . 0.0 110.369 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.1 tp -62.74 -44.77 95.34 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.529 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -64.98 -38.97 92.72 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.689 -179.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.605 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 64.6 m80 -93.09 -1.23 56.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.614 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.506 ' N ' ' O ' ' A' ' 13' ' ' ALA . 11.9 m120 55.92 65.29 1.48 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.532 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.2 mt -122.02 149.49 43.43 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.03 0.443 . . . . 0.0 110.326 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.515 ' H ' ' CD ' ' A' ' 19' ' ' GLU . 55.6 mp0 -41.3 151.54 0.07 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.579 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.487 HD22 ' N ' ' A' ' 20' ' ' LEU . 3.5 mm? -61.54 137.74 94.86 Favored Pre-proline 0 C--N 1.315 -0.892 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.914 -178.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.28 154.54 56.46 Favored 'Trans proline' 0 C--N 1.317 -1.101 0 C-N-CA 122.069 1.846 . . . . 0.0 112.004 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 68.6 t -133.17 134.87 57.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.537 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.445 ' OH ' HD23 ' A' ' 9' ' ' LEU . 29.5 m-85 -111.88 152.1 28.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.898 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.491 ' HB3' ' H ' ' A' ' 39' ' ' ASN . . . -109.84 144.78 37.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.079 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -127.08 120.34 28.72 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.915 0.388 . . . . 0.0 111.354 -179.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -133.45 127.66 33.8 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -131.18 119.23 21.57 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 120.719 0.295 . . . . 0.0 110.378 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -159.67 134.78 8.1 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 120.45 -0.5 . . . . 0.0 109.812 179.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 147.44 147.67 4.59 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 120.468 -0.872 . . . . 0.0 111.559 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -45.19 160.92 0.11 Allowed 'Trans proline' 0 N--CA 1.491 1.377 0 C-N-CA 122.389 2.06 . . . . 0.0 111.74 178.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -57.02 -43.42 54.05 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 122.864 2.376 . . . . 0.0 111.952 179.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -88.43 0.49 56.18 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.319 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -140.32 60.52 14.57 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.901 179.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -78.54 143.03 18.84 Favored 'Trans proline' 0 C--N 1.307 -1.632 0 C-N-CA 122.443 2.095 . . . . 0.0 112.048 179.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 87.9 mtm-85 -129.64 127.36 40.43 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -114.51 103.83 11.42 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 120.146 -0.622 . . . . 0.0 110.977 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.514 HH12 ' C ' ' A' ' 50' ' ' SER . 33.7 mmt180 -104.38 105.29 15.36 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.29 0.566 . . . . 0.0 110.03 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 74.1 m -114.23 134.18 55.1 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.309 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.491 ' H ' ' HB3' ' A' ' 24' ' ' ALA . 59.6 m-20 -110.14 157.89 18.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.353 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 p -122.42 120.75 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-O 121.202 0.525 . . . . 0.0 110.108 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 52.0 m -102.73 119.86 39.57 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.439 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.516 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.4 t80 -143.91 138.54 28.62 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.183 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.451 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 48.7 t 42.62 32.77 0.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.811 0.338 . . . . 0.0 110.909 179.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.27 30.27 59.0 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.516 ' N ' ' O ' ' A' ' 42' ' ' PHE . 99.1 mm-40 -125.19 119.23 27.95 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.817 0.342 . . . . 0.0 110.245 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 26.3 p -109.78 100.73 9.69 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.555 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -107.85 143.24 36.72 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.417 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.43 ' OE1' ' OD1' ' A' ' 39' ' ' ASN . 18.0 pt20 -153.52 154.04 33.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.772 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.3 p -82.35 162.21 22.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.403 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.514 ' C ' HH12 ' A' ' 37' ' ' ARG . 91.2 p -92.11 -3.11 56.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.577 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -109.77 153.28 24.57 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.239 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.629 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 1.0 OUTLIER -102.23 122.85 45.0 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 121.735 0.779 . . . . 0.0 109.923 -179.228 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.409 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.6 OUTLIER -78.34 148.98 75.05 Favored Pre-proline 0 C--N 1.306 -1.303 0 CA-C-N 114.144 -1.389 . . . . 0.0 110.748 -179.847 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -77.72 -6.48 16.12 Favored 'Trans proline' 0 N--CA 1.493 1.466 0 C-N-CA 122.628 2.218 . . . . 0.0 112.35 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -136.11 153.52 51.28 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 120.981 0.42 . . . . 0.0 110.384 -179.308 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.64 -60.32 3.48 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.007 -179.231 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -55.02 -34.09 63.19 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.927 -177.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.9 m -57.13 -35.88 70.01 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.206 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.53 -47.81 52.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.813 0.339 . . . . 0.0 111.283 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -62.56 -42.1 99.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.356 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -66.32 -45.74 79.27 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.683 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.45 -38.35 84.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.714 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.72 -48.0 82.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.552 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.452 ' O ' HG12 ' A' ' 68' ' ' VAL . . . -58.4 -38.69 77.86 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.402 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -55.12 -43.21 73.88 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.007 0.432 . . . . 0.0 110.107 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 62.4 mt -68.13 -42.95 85.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.439 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.413 ' O ' ' OG ' ' A' ' 70' ' ' SER . . . -65.48 -49.31 69.52 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.032 0.444 . . . . 0.0 111.657 -178.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.452 HG12 ' O ' ' A' ' 64' ' ' ALA . 8.8 p -67.25 -29.02 44.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.369 -179.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.8 -27.42 62.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.825 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 67' ' ' ALA . 83.6 p -73.77 -38.31 64.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.051 0.453 . . . . 0.0 110.522 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 63.7 mt -67.2 -30.63 70.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.617 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 20.7 p . . . . . 0 C--N 1.325 -0.488 0 CA-C-O 117.958 -1.02 . . . . 0.0 110.782 -179.894 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.2 mtp . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -61.84 -43.59 98.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.517 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 73.1 m80 39.08 42.37 0.69 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.088 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.415 ' H ' HG22 ' A' ' 4' ' ' VAL . 15.3 m -83.77 -16.38 11.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.991 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.657 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 4.3 m-85 -61.27 -42.54 98.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.738 -179.221 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -59.35 -42.66 92.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.372 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.44 -24.29 63.43 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 111.229 -0.748 . . . . 0.0 111.229 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -76.92 -48.61 17.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.0 0.428 . . . . 0.0 110.938 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 33.6 tp -62.95 -41.52 99.53 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.09 -179.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -62.01 -41.75 98.4 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 119.701 -0.8 . . . . 0.0 110.614 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.61 -36.4 80.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.631 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.621 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 76.2 t80 -61.25 -51.18 70.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.596 -179.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.476 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -56.76 -48.96 76.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.084 0.468 . . . . 0.0 110.23 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.1 tp -62.68 -43.81 97.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.462 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -64.0 -40.31 96.08 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.626 -179.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.621 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 62.8 m80 -90.56 -4.94 56.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.63 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.476 ' N ' ' O ' ' A' ' 13' ' ' ALA . 63.3 t30 62.98 66.62 0.73 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.611 179.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.7 mt -127.67 148.3 50.39 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.457 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -45.78 136.94 5.8 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.932 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.0 mt -47.31 143.89 4.81 Favored Pre-proline 0 C--N 1.319 -0.749 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.993 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -72.66 155.92 53.91 Favored 'Trans proline' 0 N--CA 1.494 1.509 0 C-N-CA 122.465 2.11 . . . . 0.0 112.016 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 74.9 t -129.58 130.34 67.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.445 179.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -106.55 152.4 23.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.333 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.453 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -113.68 145.86 40.69 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.388 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -125.02 121.96 35.89 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.742 0.306 . . . . 0.0 111.146 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -131.77 129.4 40.52 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 177.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 70.6 ttt-85 -130.84 118.55 20.94 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -158.34 134.05 8.97 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.532 -0.467 . . . . 0.0 109.894 179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.04 142.96 3.69 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 120.219 -0.991 . . . . 0.0 111.536 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -43.88 164.94 0.04 OUTLIER 'Trans proline' 0 N--CA 1.488 1.206 0 C-N-CA 121.766 1.644 . . . . 0.0 112.392 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.6 -48.28 22.71 Favored 'Trans proline' 0 N--CA 1.499 1.848 0 C-N-CA 122.424 2.083 . . . . 0.0 112.715 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -88.97 4.88 46.63 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.579 -179.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.35 61.05 18.55 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.838 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -80.05 141.52 14.85 Favored 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.471 2.114 . . . . 0.0 111.65 178.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -131.0 129.37 41.99 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 178.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -114.89 104.15 11.64 Favored 'General case' 0 CA--C 1.508 -0.642 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.187 179.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.8 mtp180 -100.52 105.94 17.43 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.674 -0.41 . . . . 0.0 109.9 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.453 ' SG ' ' O ' ' A' ' 24' ' ' ALA . 44.1 t -110.63 125.26 53.24 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 120.96 0.41 . . . . 0.0 110.37 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -108.02 155.62 20.15 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.152 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.457 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.3 p -123.27 120.04 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.086 0.47 . . . . 0.0 110.347 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 95.4 m -97.92 119.27 36.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.233 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.491 ' CD2' ' SG ' ' A' ' 43' ' ' CYS . 5.3 t80 -140.07 139.44 35.9 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.337 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.491 ' SG ' ' CD2' ' A' ' 42' ' ' PHE . 6.2 m 44.11 32.25 0.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.6 32.32 54.67 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.496 -0.642 . . . . 0.0 111.496 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 42' ' ' PHE . 84.7 mt-30 -134.75 120.69 19.74 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.766 0.317 . . . . 0.0 110.253 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.2 m -102.72 107.68 18.65 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 121.02 0.438 . . . . 0.0 110.885 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -91.16 141.12 29.15 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.157 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -142.71 139.11 30.99 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.522 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.9 p -81.77 162.69 22.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.436 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.9 m -90.63 -9.24 47.69 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.732 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -120.99 142.37 49.85 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.266 0.555 . . . . 0.0 110.602 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.573 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.0 140.19 29.9 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.956 -179.368 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.411 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.3 OUTLIER -92.33 147.93 35.49 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 114.711 -1.131 . . . . 0.0 111.12 -179.701 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -77.03 -4.61 15.07 Favored 'Trans proline' 0 N--CA 1.498 1.792 0 C-N-CA 122.807 2.338 . . . . 0.0 112.582 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.02 154.29 51.24 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.243 0.544 . . . . 0.0 111.143 -179.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.67 -64.86 0.78 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.632 -178.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -56.1 -35.45 67.04 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 120.731 0.301 . . . . 0.0 110.567 -177.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 40.2 t -56.45 -34.19 66.62 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.986 179.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.88 -39.46 79.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.27 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -62.43 -41.73 98.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.6 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.657 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -62.01 -52.17 65.06 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.162 0.506 . . . . 0.0 110.446 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.567 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -64.97 -37.24 86.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.743 -178.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.59 -45.46 91.81 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.437 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.482 ' O ' HG23 ' A' ' 68' ' ' VAL . . . -68.16 -34.09 75.67 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.906 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -59.35 -52.8 64.08 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 121.092 -0.243 . . . . 0.0 111.421 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.403 HG13 ' N ' ' A' ' 67' ' ' ALA . 12.4 pt -57.82 -45.57 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.124 -179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.403 ' N ' HG13 ' A' ' 66' ' ' ILE . . . -66.88 -43.36 83.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.083 0.468 . . . . 0.0 110.659 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 64' ' ' ALA . 18.4 t -60.6 -42.71 92.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.064 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.67 -27.72 69.42 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.696 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.4 m -67.56 -40.98 84.93 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.818 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 57.6 mt -66.77 -30.62 70.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.481 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 21.7 m . . . . . 0 C--N 1.325 -0.46 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.76 179.959 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 39.8 ttm . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -77.07 153.03 34.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.654 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.621 ' ND1' ' CE1' ' A' ' 61' ' ' HIS . 85.9 t60 55.54 50.66 14.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.009 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.8 m -109.76 -11.58 11.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-O 121.013 0.435 . . . . 0.0 110.738 179.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -60.91 -44.52 97.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.653 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -59.83 -42.55 93.8 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.598 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.47 -34.92 91.2 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -74.99 -44.51 47.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.063 0.459 . . . . 0.0 111.053 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.453 HD23 ' OH ' ' A' ' 23' ' ' TYR . 49.1 tp -62.97 -40.79 98.78 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.199 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -66.29 -40.06 89.8 Favored 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 119.901 -0.72 . . . . 0.0 110.785 -179.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.28 -40.15 89.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.449 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -62.91 -48.18 80.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.67 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.71 -40.27 62.84 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.381 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.413 ' O ' ' ND2' ' A' ' 17' ' ' ASN . 49.3 tp -63.49 -44.84 93.2 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.429 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 67.6 tp60 -70.29 -41.01 73.95 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.989 0.424 . . . . 0.0 111.122 -178.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.463 ' ND1' ' O ' ' A' ' 16' ' ' HIS . 58.7 t-80 -74.0 -14.0 60.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.608 -179.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.413 ' ND2' ' O ' ' A' ' 14' ' ' LEU . 20.8 m120 54.83 69.0 0.78 Allowed 'General case' 0 C--O 1.233 0.198 0 C-N-CA 120.886 -0.325 . . . . 0.0 111.762 178.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -147.07 169.45 19.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.316 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -43.37 131.37 4.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.183 178.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.498 HD12 ' N ' ' A' ' 20' ' ' LEU . 10.9 mp -53.94 152.35 10.54 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.717 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -66.82 148.61 82.77 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 C-N-CA 122.447 2.098 . . . . 0.0 112.085 179.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 75.0 t -132.84 132.2 59.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.561 179.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.453 ' OH ' HD23 ' A' ' 9' ' ' LEU . 32.1 m-85 -107.99 151.32 25.98 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.468 179.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -126.16 131.96 51.92 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -112.65 137.61 50.67 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.854 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -139.84 150.39 44.61 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.6 ttt-85 -120.84 127.41 51.89 Favored 'General case' 0 CA--C 1.515 -0.366 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -162.78 105.95 1.07 Allowed 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.894 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 167.3 -175.12 42.47 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 120.285 -0.959 . . . . 0.0 111.028 -179.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -45.06 155.7 0.31 Allowed 'Trans proline' 0 C--N 1.305 -1.741 0 C-N-CA 122.54 2.16 . . . . 0.0 111.599 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.31 -57.47 0.26 Allowed 'Trans proline' 0 N--CA 1.5 1.885 0 C-N-CA 122.504 2.136 . . . . 0.0 112.678 -179.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.46 ' O ' ' CG ' ' A' ' 32' ' ' HIS . 83.2 t60 -84.87 -6.48 59.35 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.465 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -144.01 62.56 10.62 Favored Pre-proline 0 CA--C 1.531 0.243 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -75.03 157.83 42.44 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 C-N-CA 122.771 2.314 . . . . 0.0 112.578 -179.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -104.27 145.92 29.54 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -112.49 105.17 13.34 Favored 'General case' 0 CA--C 1.51 -0.57 0 C-N-CA 120.565 -0.454 . . . . 0.0 111.648 -178.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 -101.4 108.65 20.31 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.426 ' C ' HD22 ' A' ' 39' ' ' ASN . 62.0 m -115.01 143.67 44.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.921 0.391 . . . . 0.0 110.633 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.527 ' OD1' ' NE2' ' A' ' 48' ' ' GLN . 3.0 m120 -116.36 157.52 24.91 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.949 179.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.452 ' O ' HG13 ' A' ' 40' ' ' VAL . 3.7 p -124.31 121.06 60.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.928 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 64.7 m -96.37 124.67 40.45 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.622 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.478 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.1 t80 -146.35 139.64 25.8 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.238 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.495 ' SG ' ' O ' ' A' ' 43' ' ' CYS . 42.9 t 42.99 32.79 0.45 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.915 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 74.98 28.06 63.26 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 42' ' ' PHE . 87.0 mt-30 -131.32 130.85 43.27 Favored 'General case' 0 C--O 1.233 0.211 0 O-C-N 122.724 -0.28 . . . . 0.0 110.42 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 63.6 p -108.76 104.63 13.95 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.968 0.414 . . . . 0.0 110.879 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -89.83 140.68 29.37 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.964 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.527 ' NE2' ' OD1' ' A' ' 39' ' ' ASN . 87.8 mt-30 -141.01 154.77 46.16 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.313 -179.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 42.8 m -100.45 157.78 16.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.52 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.9 t -89.53 -2.6 58.4 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.718 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -116.85 136.34 53.03 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.268 0.556 . . . . 0.0 110.308 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.579 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -92.68 144.95 24.81 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 115.151 -0.932 . . . . 0.0 109.71 -179.578 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.55 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -105.97 148.05 35.86 Favored Pre-proline 0 CA--C 1.545 0.767 0 CA-C-N 114.623 -1.171 . . . . 0.0 111.085 179.783 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.87 -3.54 13.61 Favored 'Trans proline' 0 N--CA 1.5 1.891 0 C-N-CA 122.938 2.425 . . . . 0.0 112.64 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.429 HG22 ' N ' ' A' ' 56' ' ' LEU . 89.3 m -134.88 154.24 51.74 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.04 0.447 . . . . 0.0 111.24 -179.187 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.429 ' N ' HG22 ' A' ' 55' ' ' THR . 0.4 OUTLIER -65.19 -62.98 1.22 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.506 -178.706 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.473 ' O ' ' ND1' ' A' ' 61' ' ' HIS . 98.5 mttt -54.1 -33.57 58.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.738 0.304 . . . . 0.0 110.593 -177.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 37.5 m -56.95 -34.71 68.29 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.434 -0.507 . . . . 0.0 110.032 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.448 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -73.1 -44.28 60.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.45 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -60.25 -41.92 94.23 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.741 -179.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.621 ' CE1' ' ND1' ' A' ' 3' ' ' HIS . 0.3 OUTLIER -61.81 -49.67 75.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.662 -179.727 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.51 -33.75 74.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.84 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.13 -49.19 77.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.825 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.67 -31.29 70.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.625 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -54.68 -46.21 74.03 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 121.124 -0.23 . . . . 0.0 110.75 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 23.3 pt -74.92 -30.88 24.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.817 0.341 . . . . 0.0 110.654 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.94 -52.07 22.08 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.125 0.488 . . . . 0.0 111.672 -179.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.1 p -61.71 -31.02 49.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.355 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.04 -28.64 64.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.731 179.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 78.0 p -69.27 -39.31 78.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.734 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 42.5 mt -68.26 -30.93 70.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.511 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 22.1 p . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 118.161 -0.924 . . . . 0.0 110.782 -179.934 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 97.2 mtp . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -90.64 114.21 26.44 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.391 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.626 ' CG ' ' CE1' ' A' ' 61' ' ' HIS . 2.7 m-70 -69.12 73.85 0.31 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.532 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.0 m -95.64 -16.33 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 CA-C-N 116.561 -0.291 . . . . 0.0 110.742 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -56.22 -45.76 79.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.848 0.356 . . . . 0.0 111.067 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -59.99 -41.57 92.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.579 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.84 -30.79 72.49 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.48 -0.648 . . . . 0.0 111.48 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 -76.81 -48.91 17.12 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.213 0.53 . . . . 0.0 110.631 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.2 tp -61.97 -42.59 99.31 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.507 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.2 tp60 -65.29 -40.93 94.46 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.531 -179.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.76 -39.29 76.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.807 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.467 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 90.3 t80 -61.86 -49.93 74.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.151 -179.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.405 ' HB2' ' HZ ' ' A' ' 42' ' ' PHE . . . -55.89 -52.25 64.73 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.19 0.519 . . . . 0.0 110.592 -179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.6 tp -63.68 -42.93 97.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.828 -179.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -53.71 -39.42 65.2 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.67 -178.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.467 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 77.7 m80 -97.79 2.75 49.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.587 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.594 ' C ' HD12 ' A' ' 18' ' ' LEU . 62.3 t30 64.54 67.37 0.57 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.022 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.594 HD12 ' C ' ' A' ' 17' ' ' ASN . 9.5 mp -115.21 -172.97 2.23 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.545 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.3 pt-20 -91.77 139.77 30.35 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.941 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.588 HD12 ' N ' ' A' ' 20' ' ' LEU . 10.2 mp -47.53 141.9 6.7 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.03 -179.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.98 158.19 42.42 Favored 'Trans proline' 0 N--CA 1.495 1.578 0 C-N-CA 122.87 2.38 . . . . 0.0 111.824 179.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.6 t -129.96 134.65 62.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.547 179.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -114.24 154.64 27.57 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.238 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -118.67 144.51 46.15 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.0 178.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -123.86 125.38 44.56 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.254 0.55 . . . . 0.0 111.162 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -134.39 127.75 32.23 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -128.87 120.37 26.11 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.187 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -158.55 132.42 7.72 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.51 140.74 3.31 Favored Glycine 0 CA--C 1.534 1.233 0 C-N-CA 120.493 -0.86 . . . . 0.0 111.072 179.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -43.44 167.14 0.03 OUTLIER 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.417 2.078 . . . . 0.0 112.92 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.06 -50.56 13.19 Favored 'Trans proline' 0 N--CA 1.5 1.856 0 C-N-CA 122.883 2.388 . . . . 0.0 113.059 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.454 ' H ' ' CD2' ' A' ' 32' ' ' HIS . 15.8 p80 -89.42 4.52 48.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.696 -179.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.66 61.52 19.5 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.813 179.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -81.87 143.16 12.96 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.624 2.216 . . . . 0.0 112.043 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -132.35 128.93 38.7 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -113.86 104.16 11.91 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.756 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 84.0 mtp180 -103.58 105.82 16.16 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.108 0.48 . . . . 0.0 109.978 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 69.4 m -115.28 133.39 56.08 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.119 0.485 . . . . 0.0 111.26 -179.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.415 ' OD1' ' NE2' ' A' ' 48' ' ' GLN . 97.7 m-20 -110.27 153.36 24.95 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.522 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.473 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.2 p -120.48 119.83 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.316 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 73.6 m -97.32 119.64 36.21 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.377 179.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.405 ' HZ ' ' HB2' ' A' ' 13' ' ' ALA . 7.2 t80 -143.18 139.63 30.41 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.462 -179.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.423 ' SG ' ' O ' ' A' ' 43' ' ' CYS . 49.5 t 47.98 32.28 2.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.842 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 72.99 31.38 61.98 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -137.43 132.68 33.76 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 40.9 p -108.71 107.01 17.3 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.032 -179.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.42 ' HZ ' ' HG ' ' A' ' 70' ' ' SER . 48.0 m-85 -93.1 140.88 29.03 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.885 179.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.415 ' NE2' ' OD1' ' A' ' 39' ' ' ASN . 57.2 tt0 -151.5 146.9 26.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.337 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.0 p -85.57 164.31 17.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.695 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.0 p -90.24 -2.02 57.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.833 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -124.45 143.19 50.77 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.407 0.623 . . . . 0.0 110.808 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.644 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.1 OUTLIER -91.45 143.14 26.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.54 -179.33 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.513 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -96.2 149.29 35.73 Favored Pre-proline 0 C--N 1.318 -0.8 0 CA-C-N 114.58 -1.191 . . . . 0.0 111.132 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -77.23 -3.59 13.86 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 123.182 2.588 . . . . 0.0 112.752 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.424 ' O ' ' OG ' ' A' ' 58' ' ' SER . 0.8 OUTLIER -134.31 155.9 49.41 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.238 0.542 . . . . 0.0 110.757 -179.508 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.4 -66.01 0.65 Allowed 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.493 -178.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.5 pttt -53.22 -34.19 56.01 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.603 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.424 ' OG ' ' O ' ' A' ' 55' ' ' THR . 77.4 p -57.63 -33.27 68.09 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.579 179.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.41 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -71.11 -40.87 71.22 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.941 0.401 . . . . 0.0 110.888 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -65.37 -40.32 93.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.402 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.626 ' CE1' ' CG ' ' A' ' 3' ' ' HIS . 27.7 m170 -62.98 -50.31 71.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.749 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.25 -34.46 78.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.761 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.32 -46.35 86.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.598 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.77 -33.67 75.29 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.823 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 53.9 tttp -54.11 -46.03 72.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.587 0.232 . . . . 0.0 110.845 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.2 pt -74.84 -29.55 22.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.679 179.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.89 -51.49 25.88 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.471 -179.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.0 p -63.36 -29.01 46.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.281 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.82 -31.22 67.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 0.0 110.68 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.42 ' HG ' ' HZ ' ' A' ' 47' ' ' PHE . 37.1 t -66.29 -42.92 87.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.675 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 52.3 mt -66.11 -30.19 70.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.696 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 29.3 m . . . . . 0 C--O 1.22 -0.475 0 CA-C-O 118.095 -0.955 . . . . 0.0 110.406 -179.885 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.9 ptm . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' A' ' 2' ' ' ASP . 63.9 t0 -62.06 -39.72 93.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.557 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.1 m170 45.11 85.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.452 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.401 HG22 ' H ' ' A' ' 4' ' ' VAL . 31.3 m -89.79 -18.63 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-O 120.863 0.363 . . . . 0.0 110.756 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.523 ' CE1' ' NE2' ' A' ' 61' ' ' HIS . 4.4 m-85 -53.58 -45.02 69.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.792 -179.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -62.12 -41.09 97.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.637 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.48 -30.36 56.7 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.249 -0.741 . . . . 0.0 111.249 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -75.63 -47.32 26.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.808 0.337 . . . . 0.0 111.106 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 35.0 tp -61.56 -43.13 99.43 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.385 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -64.25 -41.52 96.92 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.836 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.06 -36.96 78.24 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.584 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.631 ' CE2' ' CE1' ' A' ' 16' ' ' HIS . 50.0 t80 -59.73 -50.69 72.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.823 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.4 -48.34 77.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.489 179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 47.7 tp -62.02 -43.71 98.26 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.611 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -63.69 -39.3 93.98 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.712 -179.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.631 ' CE1' ' CE2' ' A' ' 12' ' ' TYR . 57.8 m80 -89.36 2.48 54.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.549 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 61.6 t30 60.0 61.66 1.83 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.526 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.8 mt -131.2 148.52 52.71 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.599 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -48.29 134.67 14.48 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.016 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.556 ' N ' HD12 ' A' ' 20' ' ' LEU . 10.1 mp -48.51 150.02 2.6 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.858 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -70.92 152.57 63.43 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 C-N-CA 122.587 2.191 . . . . 0.0 111.934 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 79.6 t -129.2 128.76 67.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.415 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -104.82 152.49 22.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.402 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.465 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -126.0 132.68 51.97 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.207 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.482 ' ND2' ' SG ' ' A' ' 38' ' ' CYS . 8.3 m120 -110.39 136.44 49.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.956 0.407 . . . . 0.0 110.882 -178.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -139.74 149.69 43.91 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.022 179.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -124.78 129.45 50.48 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.7 tm-20 -165.01 108.45 0.86 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.114 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 165.94 -173.16 41.51 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.044 -0.823 . . . . 0.0 111.044 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.448 ' O ' ' N ' ' A' ' 34' ' ' PRO . 76.5 Cg_exo -45.64 130.05 11.95 Favored 'Trans proline' 0 C--N 1.309 -1.541 0 C-N-CA 122.698 2.265 . . . . 0.0 111.798 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_exo -46.12 -56.96 2.48 Favored 'Trans proline' 0 C--N 1.31 -1.476 0 C-N-CA 122.276 1.984 . . . . 0.0 113.099 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -78.34 -11.8 59.96 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.74 -179.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -144.66 67.4 14.1 Favored Pre-proline 0 CA--C 1.541 0.598 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.448 ' N ' ' O ' ' A' ' 30' ' ' PRO . 64.0 Cg_endo -77.82 156.6 31.16 Favored 'Trans proline' 0 C--N 1.3 -1.989 0 C-N-CA 122.608 2.206 . . . . 0.0 112.766 -178.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -101.26 145.35 28.96 Favored 'General case' 0 CA--C 1.515 -0.397 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -111.49 106.84 15.85 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-O 121.203 0.525 . . . . 0.0 111.938 -179.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -100.28 108.28 20.3 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.482 ' SG ' ' ND2' ' A' ' 25' ' ' ASN . 35.3 t -111.74 134.5 53.27 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.834 -179.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -112.54 157.58 20.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.225 179.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.465 ' O ' HG13 ' A' ' 40' ' ' VAL . 4.9 p -122.49 120.57 61.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-O 120.87 0.367 . . . . 0.0 110.277 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 93.8 m -95.66 121.17 37.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.562 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -144.1 132.28 21.8 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.019 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.476 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 44.9 t 49.43 32.21 4.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.904 0.383 . . . . 0.0 110.878 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 75.03 31.54 57.65 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 111.467 -0.653 . . . . 0.0 111.467 179.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -134.31 128.86 34.6 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 76.2 p -107.73 106.87 17.38 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.027 -179.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -92.82 142.23 27.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.122 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -138.39 160.08 40.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.376 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.9 t -100.32 161.12 13.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.437 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.0 p -90.99 -5.94 54.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.562 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.545 ' N ' ' OE1' ' A' ' 51' ' ' GLU . 55.9 mp0 -117.72 139.89 50.41 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.114 0.483 . . . . 0.0 110.495 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.576 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -94.62 145.32 24.91 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.919 -179.166 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.524 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.0 OUTLIER -107.9 147.19 34.99 Favored Pre-proline 0 C--N 1.315 -0.913 0 CA-C-N 115.014 -0.993 . . . . 0.0 111.065 179.763 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -77.91 -3.41 13.48 Favored 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 122.736 2.291 . . . . 0.0 112.555 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 p -134.26 153.98 51.55 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.007 0.432 . . . . 0.0 111.064 -179.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.17 -63.76 1.01 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.275 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -52.31 -34.41 46.8 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.995 -177.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 34.6 m -57.55 -33.39 68.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.856 0.36 . . . . 0.0 110.527 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.432 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -72.74 -46.22 54.63 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.164 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -59.04 -34.93 72.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.432 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.523 ' NE2' ' CE1' ' A' ' 5' ' ' TYR . 2.7 t-80 -62.31 -60.01 4.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.872 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.406 ' N ' ' ND1' ' A' ' 61' ' ' HIS . . . -64.91 -34.92 79.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.772 -179.365 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.98 -52.6 65.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.955 -179.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.58 -39.58 80.74 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.81 -179.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -57.18 -48.71 78.07 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.668 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 96.7 mt -56.82 -46.99 83.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.304 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.94 -45.8 73.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.025 0.44 . . . . 0.0 110.431 179.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.0 t -57.04 -41.25 77.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.004 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -66.49 -27.24 67.63 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.827 0.346 . . . . 0.0 110.675 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.4 m -67.77 -40.15 84.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.734 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 49.9 mt -67.91 -30.08 69.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.429 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.1 t . . . . . 0 C--O 1.219 -0.534 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.686 -179.561 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.0 mtt . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -88.86 110.25 20.9 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.469 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 75.6 t60 -74.78 69.76 1.84 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.669 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.5 m -104.25 -13.89 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 CA-C-O 120.784 0.326 . . . . 0.0 110.855 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.657 ' CE1' ' ND1' ' A' ' 61' ' ' HIS . 5.7 m-85 -58.24 -45.58 87.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.717 -179.185 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -59.43 -41.98 90.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.969 0.414 . . . . 0.0 110.253 179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.57 -32.54 83.59 Favored Glycine 0 CA--C 1.526 0.766 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -76.51 -47.38 22.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.007 0.432 . . . . 0.0 111.158 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.8 tp -62.2 -42.55 99.4 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.303 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -62.61 -41.4 98.97 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 119.692 -0.803 . . . . 0.0 110.691 -178.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.42 -37.39 82.98 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.572 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.617 ' CE1' ' CE1' ' A' ' 16' ' ' HIS . 63.0 t80 -61.32 -50.96 70.87 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.669 -179.497 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.77 -47.28 80.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.971 0.415 . . . . 0.0 110.266 -179.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.5 tp -62.16 -45.38 93.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.503 -179.21 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -65.01 -38.18 90.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.506 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.617 ' CE1' ' CE1' ' A' ' 12' ' ' TYR . 62.4 m80 -91.17 2.28 56.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.536 -179.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 54.53 65.04 1.61 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.686 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 74.5 mt -127.65 151.32 49.09 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.089 0.471 . . . . 0.0 110.567 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -47.68 139.26 7.4 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.845 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.9 pp -52.68 146.19 18.82 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.902 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -72.35 153.24 55.92 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 122.5 2.133 . . . . 0.0 112.119 179.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.5 t -129.79 131.21 66.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.523 179.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -106.99 152.41 24.02 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.34 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -128.18 110.72 12.7 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 178.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.448 ' OD1' ' O ' ' A' ' 25' ' ' ASN . 40.7 p30 -107.3 144.14 34.56 Favored 'General case' 0 CA--C 1.517 -0.302 0 O-C-N 123.713 0.633 . . . . 0.0 110.987 -178.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.451 ' OE1' ' N ' ' A' ' 27' ' ' ARG . 0.7 OUTLIER -145.04 148.63 33.91 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.252 178.786 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.451 ' N ' ' OE1' ' A' ' 26' ' ' GLU . 61.7 ttp180 -129.82 125.13 35.0 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.648 0.261 . . . . 0.0 110.432 179.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -160.01 130.33 5.51 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.459 -0.497 . . . . 0.0 109.745 179.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 149.49 143.77 3.82 Favored Glycine 0 CA--C 1.532 1.099 0 C-N-CA 120.354 -0.927 . . . . 0.0 111.272 179.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -43.67 167.68 0.03 OUTLIER 'Trans proline' 0 N--CA 1.489 1.23 0 C-N-CA 122.022 1.814 . . . . 0.0 112.446 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -55.68 -52.72 6.9 Favored 'Trans proline' 0 N--CA 1.5 1.857 0 C-N-CA 122.485 2.123 . . . . 0.0 112.501 179.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -86.04 5.53 33.06 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.663 -179.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.0 60.02 16.83 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.833 178.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -77.93 139.52 17.47 Favored 'Trans proline' 0 C--N 1.311 -1.426 0 C-N-CA 122.599 2.199 . . . . 0.0 111.755 178.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.9 mmt180 -128.78 129.42 45.64 Favored 'General case' 0 CA--C 1.512 -0.497 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 179.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -115.04 102.19 9.7 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.332 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 85.7 mtp180 -101.16 106.93 18.22 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 9.9 t -114.87 129.21 56.66 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.016 -179.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -109.39 157.79 18.57 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.665 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.477 ' O ' HG13 ' A' ' 40' ' ' VAL . 5.4 p -125.24 121.32 60.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.196 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 99.1 m -98.52 123.93 42.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.737 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -146.23 132.81 19.81 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.312 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.476 ' O ' ' SG ' ' A' ' 43' ' ' CYS . 51.8 t 47.84 45.14 18.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.837 0.351 . . . . 0.0 110.615 179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 61.7 31.55 78.41 Favored Glycine 0 CA--C 1.522 0.505 0 N-CA-C 111.244 -0.742 . . . . 0.0 111.244 179.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.432 ' CG ' ' CE1' ' A' ' 47' ' ' PHE . 11.9 tp-100 -136.81 123.31 20.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.843 0.354 . . . . 0.0 110.167 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.97 109.62 21.68 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.299 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.472 ' CE2' ' OG ' ' A' ' 70' ' ' SER . 60.0 m-85 -91.99 141.04 29.05 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.971 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.468 ' CD ' ' N ' ' A' ' 48' ' ' GLN . 2.6 pm0 -149.71 156.02 41.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.176 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.6 t -96.52 170.75 9.0 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.429 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.5 p -99.21 -0.35 41.64 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.543 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -128.23 129.69 46.8 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.187 0.518 . . . . 0.0 110.706 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.92 148.0 32.85 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.992 -179.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.479 ' CD1' ' N ' ' A' ' 53' ' ' PHE . 0.1 OUTLIER -99.2 147.62 33.52 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.165 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -74.88 -6.89 18.71 Favored 'Trans proline' 0 N--CA 1.497 1.71 0 C-N-CA 122.741 2.294 . . . . 0.0 112.457 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 p -133.45 155.0 50.33 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.221 0.534 . . . . 0.0 111.095 -179.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.77 -64.16 0.91 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.425 -178.549 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -53.71 -33.05 54.27 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.805 0.336 . . . . 0.0 110.381 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.4 t -56.92 -36.93 70.77 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.026 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.422 ' HB2' ' CD1' ' A' ' 53' ' ' PHE . . . -68.8 -45.45 71.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.457 -179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.62 -39.48 84.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.29 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.657 ' ND1' ' CE1' ' A' ' 5' ' ' TYR . 0.0 OUTLIER -64.32 -52.45 58.39 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.256 0.55 . . . . 0.0 110.735 179.949 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.566 ' N ' ' CG ' ' A' ' 61' ' ' HIS . . . -65.63 -36.0 82.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.111 -178.553 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.81 -49.28 78.28 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.569 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.62 -32.1 70.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.787 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -54.77 -45.37 74.23 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.675 0.274 . . . . 0.0 110.832 -179.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 23.1 pt -74.08 -34.43 38.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 120.935 0.397 . . . . 0.0 110.677 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.53 -50.63 43.22 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.032 0.444 . . . . 0.0 111.666 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.5 p -63.07 -32.38 56.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.2 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.32 -28.08 65.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.57 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.472 ' OG ' ' CE2' ' A' ' 47' ' ' PHE . 18.5 m -68.93 -41.24 78.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.688 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 53.4 mt -67.27 -30.48 70.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.697 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.529 179.962 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.1 ttp . . . . . 0 N--CA 1.489 1.504 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -67.82 142.62 56.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.391 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.609 ' CD2' ' CD2' ' A' ' 61' ' ' HIS . 98.2 m-70 -107.91 120.08 41.26 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.563 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.1 m -109.36 -10.98 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.081 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.674 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -60.33 -45.97 91.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.684 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -61.08 -45.11 96.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.458 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.0 -34.84 90.95 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -73.24 -44.57 59.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.87 0.367 . . . . 0.0 111.227 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 45.6 tp -62.92 -41.19 99.38 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.417 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -64.37 -41.24 96.82 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 119.868 -0.733 . . . . 0.0 110.515 -179.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -67.73 -37.97 82.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.991 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.613 ' CE1' ' CD2' ' A' ' 16' ' ' HIS . 71.4 t80 -61.52 -50.69 71.69 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.825 -179.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.418 ' O ' ' N ' ' A' ' 17' ' ' ASN . . . -55.73 -47.69 76.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.931 0.396 . . . . 0.0 110.329 -179.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.8 tt -63.16 -43.01 99.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.979 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -64.14 -40.97 97.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.627 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.613 ' CD2' ' CE1' ' A' ' 12' ' ' TYR . 78.7 m-70 -89.49 -4.24 58.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.765 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.418 ' N ' ' O ' ' A' ' 13' ' ' ALA . 64.7 t30 61.3 65.32 0.98 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.571 179.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 78.9 mt -128.51 148.83 50.77 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.601 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.594 ' CD ' ' H ' ' A' ' 19' ' ' GLU . 1.5 mp0 -47.29 147.8 1.47 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.828 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.89 145.28 53.87 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.866 -179.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.68 153.02 64.96 Favored 'Trans proline' 0 N--CA 1.495 1.561 0 C-N-CA 122.4 2.067 . . . . 0.0 111.772 179.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 64.7 t -127.67 130.69 70.36 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.33 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -107.45 148.69 28.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.695 179.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.46 ' O ' ' SG ' ' A' ' 38' ' ' CYS . . . -124.65 111.39 15.56 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.502 ' OD1' ' SG ' ' A' ' 38' ' ' CYS . 45.3 m-80 -109.88 143.55 39.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.735 0.302 . . . . 0.0 110.612 -178.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -148.0 151.25 35.44 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -113.12 134.62 54.46 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.509 ' OE2' ' NE ' ' A' ' 37' ' ' ARG . 4.9 pt-20 -164.63 109.81 0.96 Allowed 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.662 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 164.94 -171.22 40.28 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.402 -0.904 . . . . 0.0 111.263 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.423 ' O ' ' N ' ' A' ' 34' ' ' PRO . 76.3 Cg_exo -45.18 129.92 10.61 Favored 'Trans proline' 0 C--N 1.307 -1.632 0 C-N-CA 122.18 1.92 . . . . 0.0 111.487 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -46.1 -54.86 4.18 Favored 'Trans proline' 0 N--CA 1.497 1.706 0 C-N-CA 122.128 1.886 . . . . 0.0 113.099 -179.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 62.4 t-80 -81.76 -11.26 59.09 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.256 -179.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -143.56 63.52 12.42 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.423 ' N ' ' O ' ' A' ' 30' ' ' PRO . 58.0 Cg_endo -74.07 155.68 47.47 Favored 'Trans proline' 0 N--CA 1.495 1.577 0 C-N-CA 122.426 2.084 . . . . 0.0 112.626 -178.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -101.81 144.29 30.66 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 179.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -111.39 105.98 14.76 Favored 'General case' 0 CA--C 1.5 -0.97 0 C-N-CA 120.266 -0.573 . . . . 0.0 111.744 -178.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.509 ' NE ' ' OE2' ' A' ' 28' ' ' GLU . 40.9 mtm180 -106.13 113.18 26.56 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.502 ' SG ' ' OD1' ' A' ' 25' ' ' ASN . 43.7 t -119.16 150.94 39.19 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.245 0.545 . . . . 0.0 110.97 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.422 ' OD1' ' NE2' ' A' ' 48' ' ' GLN . 94.7 m-20 -122.34 159.83 26.64 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.19 -0.913 . . . . 0.0 110.344 179.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.5 p -124.05 127.38 73.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.088 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 99.6 m -105.5 122.84 46.83 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.063 179.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.493 ' O ' ' N ' ' A' ' 45' ' ' GLN . 5.0 t80 -145.29 136.13 24.56 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 7.0 m 42.26 31.77 0.28 Allowed 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.057 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.83 25.92 61.55 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 120.994 -0.622 . . . . 0.0 111.653 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.493 ' N ' ' O ' ' A' ' 42' ' ' PHE . 85.3 mt-30 -120.44 124.57 45.78 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.724 0.297 . . . . 0.0 110.627 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.5 p -110.41 99.53 8.53 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.307 0.575 . . . . 0.0 111.012 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -100.3 140.6 34.32 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.211 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.422 ' NE2' ' OD1' ' A' ' 39' ' ' ASN . 57.2 tt0 -145.89 148.95 33.38 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.142 -179.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 44.0 t -87.73 161.72 17.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.378 179.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 79.0 p -91.6 -2.58 57.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.389 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -112.24 133.97 54.05 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.158 0.504 . . . . 0.0 110.532 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.585 ' CD1' ' N ' ' A' ' 52' ' ' PHE . 0.0 OUTLIER -91.68 144.65 25.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.648 -179.438 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.62 149.81 38.84 Favored Pre-proline 0 C--N 1.311 -1.092 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.976 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -80.4 -3.06 12.36 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 123.089 2.526 . . . . 0.0 112.666 179.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -127.77 147.69 50.42 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.327 0.584 . . . . 0.0 111.347 -179.193 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.502 HD23 ' O ' ' A' ' 56' ' ' LEU . 2.1 tt -65.51 -61.51 2.06 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.865 -178.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -56.41 -35.83 68.25 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 120.795 0.331 . . . . 0.0 111.197 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 51.2 m -55.39 -33.35 63.39 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.754 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.31 -41.45 69.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.402 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.432 ' OE2' ' ND2' ' A' ' 25' ' ' ASN . 98.4 mt-10 -65.15 -41.73 94.47 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.92 -179.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.609 ' CD2' ' CD2' ' A' ' 3' ' ' HIS . 83.6 m-70 -66.37 -45.62 79.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.052 -179.554 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.01 -36.45 84.44 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.673 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.0 -40.82 86.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.184 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.405 ' O ' HG12 ' A' ' 68' ' ' VAL . . . -68.32 -33.81 74.99 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.824 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -55.22 -46.73 75.95 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.666 0.269 . . . . 0.0 111.173 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.404 HG12 ' H ' ' A' ' 66' ' ' ILE . 21.9 pt -71.85 -38.6 65.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.429 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.44 -49.28 61.03 Favored 'General case' 0 C--O 1.232 0.172 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.405 HG12 ' O ' ' A' ' 64' ' ' ALA . 8.0 p -62.07 -31.04 50.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.886 0.374 . . . . 0.0 110.053 -179.155 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -71.88 -27.21 62.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.527 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 35.8 t -68.53 -44.47 74.51 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.82 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 56.8 mt -66.88 -30.04 70.09 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.509 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.432 0 CA-C-O 118.003 -0.999 . . . . 0.0 110.58 -179.85 . . . . . . . . 1 1 . 1 stop_ save_