data_2m0f_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 2m0f _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 ' 60' ' ' LEU . . . . . 0.464 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 95.5 mt . . . . . 0 N--CA 1.451 -0.394 0 CA-C-O 121.179 0.514 . . . . 1.2 110.821 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.2 tppt? -81.77 128.75 34.32 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.489 -0.778 . . . . 2.54 110.865 -174.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 43.2 t -91.47 101.91 14.58 Favored 'General case' 0 N--CA 1.439 -0.989 0 N-CA-C 108.617 -0.883 . . . . 0.46000000000000002 108.617 171.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -55.75 -31.92 62.97 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.602 0.564 . . . . 4.4000000000000004 111.131 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -73.14 -45.53 56.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.004 -0.544 . . . . 2.1800000000000002 111.479 -177.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.497 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 65.9 m -86.63 -41.08 14.53 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.381 0.61 . . . . 0.32000000000000001 110.712 -176.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.68 -0.56 52.61 Favored Glycine 0 N--CA 1.443 -0.891 0 N-CA-C 110.657 -0.977 . . . . 0.40000000000000002 110.657 -176.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.504 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 18.4 ptmt -92.17 -177.66 4.74 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.067 -0.567 . . . . 1.8600000000000001 109.894 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.464 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 36.1 tt0 -156.72 137.1 12.97 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.603 -0.726 . . . . 1.98 110.463 -171.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.533 ' CD1' HD22 ' A' ' 75' ' ' LEU . 62.3 m-85 -109.96 -174.69 2.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.226 -0.443 . . . . 0.87 110.132 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.4 t -140.86 17.41 2.31 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.757 0.789 . . . . 2.1600000000000001 108.948 170.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 16.9 m -131.89 128.69 39.11 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.142 -0.936 . . . . 1.49 109.555 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.9 t -65.03 -52.37 56.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.982 -1.008 . . . . 1.73 112.229 -172.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.57 -40.59 98.05 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.979 -0.629 . . . . 0.38 112.899 -176.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -63.65 -47.19 82.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.618 0.209 . . . . 1.8999999999999999 111.455 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.533 HD22 ' CD1' ' A' ' 69' ' ' PHE . 1.8 tm? -72.47 -35.72 68.28 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.263 -0.273 . . . . 1.1799999999999999 110.263 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.1 mmmt -62.6 -52.72 62.26 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.956 -0.298 . . . . 2.5299999999999998 110.958 177.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -61.43 -32.36 72.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.22 0.533 . . . . 4.5099999999999998 110.215 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -65.57 -45.64 82.55 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.394 -0.821 . . . . 0.63 110.764 178.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.551 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 23.4 mt -79.77 -19.16 49.33 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.923 0.392 . . . . 1.26 110.644 -179.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -58.8 -47.55 84.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.919 -0.582 . . . . 3.9399999999999999 109.556 173.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 65.4 mt -64.1 -41.28 91.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.511 -0.768 . . . . 2.3599999999999999 110.132 176.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.551 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 36.3 m-70 -60.31 -40.35 90.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.641 -0.708 . . . . 0.45000000000000001 111.741 178.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 28.4 m . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.338 -0.392 . . . . 1.6499999999999999 111.572 -176.507 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.51 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 79.6 mt . . . . . 0 CA--C 1.514 -0.417 0 CA-C-O 121.016 0.436 . . . . 1.2 110.604 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.408 ' HD2' ' O ' ' A' ' 67' ' ' LYS . 21.5 tptm -82.11 128.85 34.54 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.552 -0.749 . . . . 2.54 111.279 -171.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 54.1 t -89.76 106.5 18.51 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 107.715 -1.217 . . . . 0.46000000000000002 107.715 171.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.4 mtm180 -64.13 -35.88 82.2 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.373 0.606 . . . . 4.4000000000000004 110.013 -175.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -68.02 -36.01 79.25 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.931 -1.031 . . . . 2.1800000000000002 111.381 -177.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 90.4 m -97.44 -42.07 7.9 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.088 0.471 . . . . 0.32000000000000001 111.834 -178.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.98 4.52 48.05 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 121.021 -0.609 . . . . 0.40000000000000002 111.622 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.408 ' O ' ' HD2' ' A' ' 61' ' ' LYS . 17.0 ptmt -103.92 -176.28 3.04 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 123.273 0.629 . . . . 1.8600000000000001 109.354 179.003 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.446 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 17.2 pt20 -148.4 151.86 35.99 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 120.799 0.333 . . . . 1.98 111.247 -174.008 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.526 ' CD1' HD23 ' A' ' 75' ' ' LEU . 58.8 m-85 -117.58 176.18 5.29 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 116.166 -0.47 . . . . 0.87 110.412 -176.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 76.3 p -112.81 -21.23 11.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.889 0.376 . . . . 2.1600000000000001 111.535 -177.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.6 p -112.22 134.16 53.93 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.409 0.623 . . . . 1.49 111.389 -175.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.51 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 23.3 m -64.01 -46.39 84.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.946 -1.025 . . . . 1.73 111.891 -175.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.9 -35.2 78.76 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.43 -0.89 . . . . 0.38 112.341 -177.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -68.48 -42.68 78.33 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.629 0.252 . . . . 1.8999999999999999 110.693 -176.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.526 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.4 tm? -72.51 -41.29 66.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.516 -0.311 . . . . 1.1799999999999999 110.825 -179.27 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.51 -41.84 79.4 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.269 -0.572 . . . . 2.5299999999999998 110.766 -177.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -62.15 -36.54 82.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.222 0.534 . . . . 4.5099999999999998 109.788 172.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . 0.41 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 82.0 t60 -63.26 -47.84 80.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.376 -0.829 . . . . 0.63 111.034 177.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.471 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 35.0 mt -73.29 -19.6 61.01 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 121.197 -0.201 . . . . 1.26 111.328 -177.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -64.91 -38.71 91.86 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.188 -0.671 . . . . 3.9399999999999999 109.188 171.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 54.8 mt -66.08 -37.14 79.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.854 -0.612 . . . . 2.3599999999999999 109.64 176.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.471 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 21.6 m-70 -67.51 -33.76 75.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.449 -0.796 . . . . 0.45000000000000001 111.658 178.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 29.2 t . . . . . 0 C--N 1.322 -0.606 0 CA-C-O 120.873 0.368 . . . . 1.6499999999999999 111.554 -177.56 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.485 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 59.7 mt . . . . . 0 CA--C 1.517 -0.319 0 CA-C-O 121.026 0.441 . . . . 1.2 110.816 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -82.14 131.38 35.24 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.429 -0.805 . . . . 2.54 111.758 -170.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 48.6 t -97.38 118.2 33.32 Favored 'General case' 0 N--CA 1.438 -1.057 0 N-CA-C 107.795 -1.187 . . . . 0.46000000000000002 107.795 169.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.419 ' HD3' ' H ' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -73.35 -40.45 64.41 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.199 0.523 . . . . 4.4000000000000004 110.141 -174.335 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -66.43 -36.59 83.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.133 -0.939 . . . . 2.1800000000000002 110.798 -176.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 94.2 m -92.6 -41.18 10.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.101 -0.499 . . . . 0.32000000000000001 110.987 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.56 9.89 54.22 Favored Glycine 0 N--CA 1.451 -0.315 0 N-CA-C 111.409 -0.676 . . . . 0.40000000000000002 111.409 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -110.63 -176.25 2.93 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 123.574 0.75 . . . . 1.8600000000000001 109.532 -178.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.485 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 3.8 pt20 -138.9 156.23 47.44 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 116.012 -0.54 . . . . 1.98 110.887 -177.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.634 ' CD1' HD23 ' A' ' 75' ' ' LEU . 40.1 m-85 -122.04 128.62 51.61 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.165 -0.47 . . . . 0.87 111.106 -178.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.418 HG23 ' HG1' ' A' ' 71' ' ' THR . 14.8 t -69.23 -14.93 63.24 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.977 -0.556 . . . . 2.1600000000000001 111.689 -179.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.418 ' HG1' HG23 ' A' ' 70' ' ' THR . 24.4 m -112.8 129.05 56.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.037 0.446 . . . . 1.49 110.274 -178.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.469 ' HA ' HD13 ' A' ' 60' ' ' LEU . 7.8 m -69.31 -53.63 18.72 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.401 -0.818 . . . . 1.73 112.333 -172.094 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.57 -27.87 73.54 Favored Glycine 0 CA--C 1.508 -0.366 0 C-N-CA 120.697 -0.763 . . . . 0.38 112.0 -178.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -66.47 -44.53 82.46 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.855 -0.424 . . . . 1.8999999999999999 109.855 178.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.634 HD23 ' CD1' ' A' ' 69' ' ' PHE . 2.5 tm? -67.7 -39.97 84.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.484 . . . . 1.1799999999999999 110.067 178.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.524 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 3.5 mmpt? -61.9 -43.3 99.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.873 0.368 . . . . 2.5299999999999998 110.829 177.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.448 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 41.6 ttm180 -66.57 -38.82 87.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.164 -0.471 . . . . 4.5099999999999998 110.58 175.157 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -64.02 -47.27 80.92 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.879 -0.601 . . . . 0.63 111.433 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.567 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 18.5 mt -75.09 -19.77 59.8 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 121.056 -0.257 . . . . 1.26 110.967 -178.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.448 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 0.3 OUTLIER -57.48 -46.13 84.04 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.938 -0.764 . . . . 3.9399999999999999 108.938 170.556 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 52.3 mt -68.18 -38.09 79.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.351 -0.84 . . . . 2.3599999999999999 110.545 178.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.567 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 16.5 m-70 -61.84 -31.22 71.45 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.282 -0.417 . . . . 0.45000000000000001 111.311 177.354 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.1 m . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 116.083 -0.508 . . . . 1.6499999999999999 111.157 -178.858 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.617 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 75.0 mt . . . . . 0 CA--C 1.514 -0.423 0 CA-C-O 120.929 0.395 . . . . 1.2 111.568 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 36.4 tptt -81.59 117.53 22.04 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.727 -0.669 . . . . 2.54 110.929 -172.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 40.4 t -78.57 112.67 15.88 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.086 -0.709 . . . . 0.46000000000000002 109.086 174.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 63.8 ttt180 -59.95 -36.99 78.25 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.054 -0.521 . . . . 4.4000000000000004 111.43 -177.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.3 mp0 -76.52 -36.01 57.97 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.029 -0.532 . . . . 2.1800000000000002 111.79 -176.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.509 ' HB3' ' HD3' ' A' ' 67' ' ' LYS . 80.1 m -93.34 -41.34 9.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.099 0.476 . . . . 0.32000000000000001 111.584 -177.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.8 -0.75 59.43 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.539 -0.755 . . . . 0.40000000000000002 111.617 -176.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.509 ' HD3' ' HB3' ' A' ' 65' ' ' CYS . 12.2 pttt -103.72 -177.78 3.47 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 108.762 -0.829 . . . . 1.8600000000000001 108.762 178.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.617 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 13.4 pt20 -145.67 156.5 43.68 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 116.484 -0.325 . . . . 1.98 111.327 -170.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.577 ' CD2' HD21 ' A' ' 75' ' ' LEU . 43.6 m-85 -131.03 137.82 49.35 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-N 116.03 -0.532 . . . . 0.87 111.416 -170.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.9 m -72.6 -32.69 66.17 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.48 -0.782 . . . . 2.1600000000000001 112.011 -173.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.495 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 24.9 m -100.97 128.84 46.82 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.392 0.615 . . . . 1.49 110.379 -179.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.482 ' HA ' HD13 ' A' ' 60' ' ' LEU . 22.9 t -64.95 -44.71 88.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.211 -0.904 . . . . 1.73 110.964 -176.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.53 -31.11 79.12 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.842 -0.694 . . . . 0.38 112.088 177.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.495 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 5.2 t30 -67.75 -45.58 74.56 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.78 -0.452 . . . . 1.8999999999999999 109.78 178.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.577 HD21 ' CD2' ' A' ' 69' ' ' PHE . 1.5 tm? -68.63 -35.35 77.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.003 -0.544 . . . . 1.1799999999999999 109.698 178.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.557 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -63.15 -47.83 81.06 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.891 -0.411 . . . . 2.5299999999999998 109.891 177.861 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.483 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 7.8 tpt180 -63.69 -38.7 92.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.29 0.567 . . . . 4.5099999999999998 110.355 175.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -61.48 -41.88 97.94 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.475 -0.784 . . . . 0.63 110.502 177.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 31.6 mt -75.85 -19.56 58.8 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.27 -0.423 . . . . 1.26 111.349 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.483 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 27.3 ttt85 -61.05 -44.07 97.93 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.587 -0.523 . . . . 3.9399999999999999 109.587 173.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 48.2 mm -61.3 -46.19 97.11 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.527 -0.761 . . . . 2.3599999999999999 110.086 175.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -58.26 -43.03 87.69 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.671 -0.695 . . . . 0.45000000000000001 111.436 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 24.2 m . . . . . 0 C--N 1.325 -0.482 0 CA-C-N 116.144 -0.48 . . . . 1.6499999999999999 111.601 -177.29 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.48 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 97.6 mt . . . . . 0 C--O 1.223 -0.299 0 CA-C-O 121.066 0.46 . . . . 1.2 111.35 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.6 tptp -81.47 132.68 35.33 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.835 -0.621 . . . . 2.54 111.112 -172.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 53.2 t -93.91 116.64 29.11 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.062 -1.088 . . . . 0.46000000000000002 108.062 171.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 46.9 mtp180 -71.9 -37.33 70.13 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.992 0.425 . . . . 4.4000000000000004 111.143 -176.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.452 ' OE2' ' HB3' ' A' ' 82' ' ' HIS . 4.5 mp0 -65.6 -35.34 80.53 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.887 -0.597 . . . . 2.1800000000000002 111.734 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 85.8 m -98.42 -40.5 8.25 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.948 0.404 . . . . 0.32000000000000001 111.512 -178.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 103.7 -6.52 48.71 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 111.442 -0.663 . . . . 0.40000000000000002 111.442 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.591 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 17.7 ptmt -90.37 -176.35 4.77 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.058 -0.571 . . . . 1.8600000000000001 110.438 -177.109 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -143.18 141.43 31.14 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.369 -0.832 . . . . 1.98 109.905 -172.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.591 ' CE1' ' HE2' ' A' ' 67' ' ' LYS . 6.6 m-85 -108.53 174.12 6.01 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 110.214 -0.291 . . . . 0.87 110.214 -177.007 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 64.8 p -119.65 -31.74 4.48 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.976 0.417 . . . . 2.1600000000000001 110.812 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.1 p -97.71 129.34 44.76 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.507 0.67 . . . . 1.49 110.815 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.48 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 20.2 p -64.87 -42.84 94.51 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.143 -0.935 . . . . 1.73 112.023 -173.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.08 -32.55 76.94 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.551 -0.833 . . . . 0.38 112.003 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -67.6 -43.65 80.01 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 121.315 -0.154 . . . . 1.8999999999999999 111.005 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.515 HD22 ' CD1' ' A' ' 69' ' ' PHE . 1.5 tm? -74.28 -35.17 63.74 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 121.04 -0.264 . . . . 1.1799999999999999 110.429 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.559 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -60.5 -55.05 38.11 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.473 0.178 . . . . 2.5299999999999998 111.309 178.384 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -62.57 -30.7 71.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.289 0.566 . . . . 4.5099999999999998 110.045 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -69.21 -43.1 74.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.331 -0.85 . . . . 0.63 111.751 -178.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.497 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 18.0 mt -79.15 -23.87 43.69 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.179 -0.609 . . . . 1.26 110.801 -178.326 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -58.27 -47.66 82.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.091 -0.504 . . . . 3.9399999999999999 110.324 173.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.7 tt -73.36 -32.47 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-O 120.688 0.28 . . . . 2.3599999999999999 110.682 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.497 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 6.7 m-70 -58.17 -49.86 75.55 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.061 0.458 . . . . 0.45000000000000001 110.646 174.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 24.1 m . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 115.854 -0.612 . . . . 1.6499999999999999 111.58 -178.545 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.533 HD11 ' HA ' ' A' ' 72' ' ' SER . 36.4 mt . . . . . 0 CA--C 1.511 -0.522 0 CA-C-O 120.948 0.404 . . . . 1.2 110.961 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.672 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 71.5 tttt -81.2 120.69 25.2 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.132 -0.486 . . . . 2.54 110.913 -175.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 16.9 t -69.18 127.98 35.02 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 109.171 -0.677 . . . . 0.46000000000000002 109.171 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 36.2 ttt-85 -66.52 -47.34 73.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.956 -0.566 . . . . 4.4000000000000004 111.345 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.2 mp0 -72.37 -39.53 67.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.16 -0.473 . . . . 2.1800000000000002 111.77 -174.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.411 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 89.3 m -88.82 -40.52 13.1 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.2 0.524 . . . . 0.32000000000000001 110.651 -177.259 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 93.77 8.48 60.65 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 115.213 -0.903 . . . . 0.40000000000000002 111.381 -174.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.411 ' HG2' ' HB2' ' A' ' 65' ' ' CYS . 0.0 OUTLIER -109.41 129.76 55.53 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 122.04 0.924 . . . . 1.8600000000000001 110.829 -175.727 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.672 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 14.5 mt-30 -86.62 147.78 25.76 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 113.826 -1.534 . . . . 1.98 112.218 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.559 ' CD1' HD22 ' A' ' 75' ' ' LEU . 24.8 m-85 -118.31 127.35 53.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.398 -0.819 . . . . 0.87 110.077 177.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.7 t -74.22 -18.78 60.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.812 0.339 . . . . 2.1600000000000001 110.656 -178.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.8 m -101.74 127.94 48.28 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.538 -0.541 . . . . 1.49 109.538 176.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.533 ' HA ' HD11 ' A' ' 60' ' ' LEU . 14.1 m -70.52 -44.12 68.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.73 -0.668 . . . . 1.73 111.756 -172.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.502 ' O ' ' HG2' ' A' ' 77' ' ' ARG . . . -65.26 -36.73 93.15 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.567 -0.825 . . . . 0.38 112.234 178.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.7 -48.8 78.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.706 0.289 . . . . 1.8999999999999999 110.407 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.559 HD22 ' CD1' ' A' ' 69' ' ' PHE . 2.2 tm? -67.31 -35.27 79.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.085 -0.507 . . . . 1.1799999999999999 110.369 -179.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.576 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -65.89 -45.42 82.1 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 110.234 -0.284 . . . . 2.5299999999999998 110.234 179.787 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.655 ' O ' ' HG2' ' A' ' 80' ' ' ARG . 23.7 mmt180 -62.35 -41.83 98.9 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.493 0.663 . . . . 4.5099999999999998 109.515 173.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -58.27 -44.82 88.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.026 -0.988 . . . . 0.63 111.463 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.468 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 18.7 mt -79.61 -25.91 41.35 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.417 0.525 . . . . 1.26 112.417 -176.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.655 ' HG2' ' O ' ' A' ' 77' ' ' ARG . 12.5 ptm180 -70.24 -18.7 63.15 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.204 -0.598 . . . . 3.9399999999999999 109.461 177.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 77' ' ' ARG . 41.0 mm -81.12 -32.45 12.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.124 -0.695 . . . . 2.3599999999999999 109.124 171.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.468 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 20.6 m-70 -68.83 -41.2 78.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.077 -0.965 . . . . 0.45000000000000001 111.33 178.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.3 p . . . . . 0 C--N 1.324 -0.542 0 CA-C-O 121.068 0.461 . . . . 1.6499999999999999 111.091 178.497 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.509 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 83.6 mt . . . . . 0 N--CA 1.45 -0.45 0 CA-C-O 121.205 0.526 . . . . 1.2 110.557 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -82.26 127.88 33.63 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.19 -0.914 . . . . 2.54 111.481 -172.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 52.5 t -88.48 106.9 18.58 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 108.578 -0.897 . . . . 0.46000000000000002 108.578 170.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -63.01 -30.11 71.35 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.133 -0.485 . . . . 4.4000000000000004 111.648 -174.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -85.32 -26.28 26.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.301 -0.409 . . . . 2.1800000000000002 111.461 -174.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 79.8 m -99.68 -42.58 6.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.04 0.447 . . . . 0.32000000000000001 111.666 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.36 -10.04 42.52 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.269 -0.732 . . . . 0.40000000000000002 111.269 -176.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.499 ' HE3' ' CZ ' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -81.22 -178.11 6.77 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 121.088 0.47 . . . . 1.8600000000000001 110.099 179.834 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.478 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 27.7 tt0 -160.34 141.22 11.99 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 115.311 -0.859 . . . . 1.98 110.378 -172.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.499 ' CZ ' ' HE3' ' A' ' 67' ' ' LYS . 96.1 m-85 -118.41 172.65 7.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.853 0.358 . . . . 0.87 111.425 -175.011 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.2 t -119.46 -10.53 9.65 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.549 0.69 . . . . 2.1600000000000001 109.243 172.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 22.8 m -99.13 128.84 45.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.734 -0.667 . . . . 1.49 110.031 177.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.509 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 14.0 m -70.61 -51.13 30.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.611 -0.722 . . . . 1.73 111.419 -174.266 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.42 ' O ' ' HG3' ' A' ' 77' ' ' ARG . . . -62.33 -33.95 87.74 Favored Glycine 0 CA--C 1.51 -0.276 0 C-N-CA 120.867 -0.682 . . . . 0.38 112.631 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -60.8 -54.48 44.64 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.908 -0.404 . . . . 1.8999999999999999 109.908 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.45 ' HG ' ' HB3' ' A' ' 60' ' ' LEU . 1.5 tm? -70.21 -32.14 69.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.842 0.353 . . . . 1.1799999999999999 110.923 -177.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.44 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -66.64 -44.98 80.5 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.411 -0.516 . . . . 2.5299999999999998 110.6 -178.741 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.42 ' HG3' ' O ' ' A' ' 73' ' ' GLY . 24.4 mtm-85 -69.4 -33.07 72.45 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.462 0.649 . . . . 4.5099999999999998 109.823 175.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 56.6 t60 -58.5 -51.63 69.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.961 -1.018 . . . . 0.63 110.465 176.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.558 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 32.8 mt -75.57 -18.92 59.61 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.177 -0.465 . . . . 1.26 111.109 178.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 49.8 ttp180 -58.01 -48.29 80.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.308 -0.405 . . . . 3.9399999999999999 109.966 177.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 38.5 pt -77.22 -25.4 15.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 2.3599999999999999 110.981 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.558 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 21.9 m-70 -65.44 -47.31 76.61 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.831 0.348 . . . . 0.45000000000000001 111.195 176.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.2 m . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 116.233 -0.44 . . . . 1.6499999999999999 111.405 -177.52 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 87.9 mt . . . . . 0 CA--C 1.515 -0.369 0 CA-C-O 120.735 0.303 . . . . 1.2 111.144 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.65 ' HD2' ' HB3' ' A' ' 68' ' ' GLN . 2.5 mptm? -80.39 129.95 34.85 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.324 -0.398 . . . . 2.54 111.053 -176.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 37.1 t -75.33 114.55 13.99 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.711 -0.848 . . . . 0.46000000000000002 108.711 170.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 63' ' ' ARG . 23.7 ttt180 -53.73 -46.13 70.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.402 -0.817 . . . . 4.4000000000000004 112.119 -176.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 30.1 mp0 -75.87 -31.36 59.23 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.106 -0.497 . . . . 2.1800000000000002 112.009 -174.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 91.6 m -98.27 -40.47 8.33 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.231 0.456 . . . . 0.32000000000000001 112.231 -174.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 100.43 -0.92 55.75 Favored Glycine 0 N--CA 1.455 -0.098 0 C-N-CA 120.874 -0.679 . . . . 0.40000000000000002 111.824 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.471 ' O ' ' HA ' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -93.1 -175.7 3.94 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 109.303 -0.629 . . . . 1.8600000000000001 109.303 179.171 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.65 ' HB3' ' HD2' ' A' ' 61' ' ' LYS . 20.6 pt20 -141.38 150.21 42.11 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.001 0.429 . . . . 1.98 111.703 -171.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.552 ' CD1' HD21 ' A' ' 75' ' ' LEU . 58.6 m-85 -118.94 177.42 4.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.827 -0.624 . . . . 0.87 109.825 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.4 p -120.26 0.35 10.61 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.171 0.51 . . . . 2.1600000000000001 111.146 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.627 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 8.3 m -126.71 130.02 49.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.876 -0.602 . . . . 1.49 110.163 -175.314 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.411 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 49.6 m -63.23 -51.25 67.0 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.597 -0.729 . . . . 1.73 111.646 -177.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.4 -28.6 73.16 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.854 -0.689 . . . . 0.38 111.873 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.627 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 41.3 t-20 -64.58 -50.67 66.33 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.705 -0.48 . . . . 1.8999999999999999 109.705 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.552 HD21 ' CD1' ' A' ' 69' ' ' PHE . 1.3 tm? -65.78 -38.87 90.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.31 -0.405 . . . . 1.1799999999999999 110.377 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.8 mmmt -66.04 -47.9 72.86 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.831 -0.348 . . . . 2.5299999999999998 111.18 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.414 ' O ' HG13 ' A' ' 81' ' ' ILE . 42.8 ttm180 -60.06 -41.57 92.65 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.234 0.54 . . . . 4.5099999999999998 109.829 175.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -59.97 -45.03 94.02 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.135 -0.939 . . . . 0.63 111.273 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.598 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 34.1 mt -78.04 -19.54 54.13 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.666 -0.414 . . . . 1.26 110.952 -176.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -69.58 -33.08 72.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.03 -0.73 . . . . 3.9399999999999999 109.03 172.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 77' ' ' ARG . 70.7 mt -75.67 -32.06 23.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.392 -0.822 . . . . 2.3599999999999999 110.024 174.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.598 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 6.1 m-70 -65.53 -37.54 87.03 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.166 -0.47 . . . . 0.45000000000000001 111.375 176.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 51.8 p . . . . . 0 C--N 1.324 -0.512 0 CA-C-O 121.085 0.469 . . . . 1.6499999999999999 110.68 177.935 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.468 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 95.8 mt . . . . . 0 CA--C 1.516 -0.343 0 N-CA-C 108.299 -1.0 . . . . 1.2 108.299 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.752 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 51.8 tttp -80.63 126.23 31.0 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.462 0.649 . . . . 2.54 112.501 -162.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 51.2 t -82.32 105.58 13.51 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 115.141 -0.936 . . . . 0.46000000000000002 108.514 174.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -62.91 -29.31 70.68 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.776 0.322 . . . . 4.4000000000000004 111.198 -176.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -79.4 -30.86 42.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.91 0.337 . . . . 2.1800000000000002 111.91 -176.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 67.0 m -94.91 -41.94 8.93 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.461 0.648 . . . . 0.32000000000000001 110.679 176.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.05 -12.1 34.26 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.092 -0.958 . . . . 0.40000000000000002 111.437 -177.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.555 ' HD2' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -110.83 128.78 55.9 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 122.399 1.095 . . . . 1.8600000000000001 111.451 -177.048 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.752 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -78.73 164.34 24.65 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 113.333 -1.758 . . . . 1.98 112.75 174.781 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -122.25 143.71 49.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.973 -1.012 . . . . 0.87 110.356 176.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.0 t -91.65 7.03 43.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.075 0.464 . . . . 2.1600000000000001 110.735 177.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.445 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 3.9 m -126.22 129.57 49.23 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.735 -0.468 . . . . 1.49 109.735 179.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.468 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 22.8 t -69.51 -50.76 42.13 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.621 -0.718 . . . . 1.73 111.733 -172.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.2 -34.94 90.74 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.51 -0.852 . . . . 0.38 111.833 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.445 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 4.7 m-20 -62.11 -50.75 70.67 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.576 -0.157 . . . . 1.8999999999999999 110.576 178.077 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.451 HD23 ' O ' ' A' ' 75' ' ' LEU . 0.6 OUTLIER -68.97 -37.01 78.54 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 123.162 0.288 . . . . 1.1799999999999999 110.796 -177.489 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.535 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -62.44 -52.26 64.24 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.67 -0.412 . . . . 2.5299999999999998 110.47 178.272 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 77' ' ' ARG . 27.9 mtp180 -62.94 -30.4 71.53 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.427 0.632 . . . . 4.5099999999999998 110.414 176.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . 0.416 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 69.8 t60 -66.32 -50.81 62.35 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.946 -1.024 . . . . 0.63 110.695 178.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.552 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 42.8 mt -75.92 -19.73 58.55 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.769 0.319 . . . . 1.26 110.807 179.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -58.93 -49.58 77.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.96 -0.564 . . . . 3.9399999999999999 109.798 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.0 tp -73.78 -30.38 28.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.037 -0.529 . . . . 2.3599999999999999 110.47 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.552 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 22.9 m-70 -61.84 -46.44 89.44 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.698 0.285 . . . . 0.45000000000000001 111.109 176.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.3 m . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 116.027 -0.533 . . . . 1.6499999999999999 111.252 -176.109 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.536 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 96.6 mt . . . . . 0 N--CA 1.448 -0.571 0 CA-C-O 121.188 0.518 . . . . 1.2 111.167 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 45.5 tptt -81.92 114.03 20.24 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.325 -0.852 . . . . 2.54 109.89 -176.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 41.8 t -70.75 109.53 5.01 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.43 -0.582 . . . . 0.46000000000000002 109.43 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -58.41 -27.3 64.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.802 -0.636 . . . . 4.4000000000000004 111.483 -177.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -93.43 -20.05 20.69 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.747 0.647 . . . . 2.1800000000000002 112.747 -175.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.427 ' HB3' ' HG3' ' A' ' 67' ' ' LYS . 64.4 m -105.87 -41.37 5.43 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.211 0.448 . . . . 0.32000000000000001 112.211 178.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.91 -0.08 59.02 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.44 -0.886 . . . . 0.40000000000000002 111.565 -175.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.444 ' HE3' ' CE1' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -108.09 -178.36 3.59 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 109.182 -0.673 . . . . 1.8600000000000001 109.182 176.104 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.536 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 27.6 tt0 -141.68 148.92 39.88 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 111.763 0.283 . . . . 1.98 111.763 -159.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.459 ' CD1' HD22 ' A' ' 75' ' ' LEU . 66.5 m-85 -126.19 140.52 52.49 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 120.815 0.341 . . . . 0.87 111.229 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.2 p -84.72 -22.25 29.8 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.281 -0.418 . . . . 2.1600000000000001 111.406 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 4.6 m -104.72 129.9 52.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.853 -0.612 . . . . 1.49 110.411 -177.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.41 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.6 m -60.59 -47.87 84.28 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.343 -0.844 . . . . 1.73 111.857 -176.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.25 -32.97 85.95 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.934 -0.65 . . . . 0.38 112.431 -179.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.418 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 5.4 m-20 -62.24 -46.36 89.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.537 0.208 . . . . 1.8999999999999999 110.873 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.459 HD22 ' CD1' ' A' ' 69' ' ' PHE . 2.1 tm? -77.18 -31.8 55.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.545 -0.298 . . . . 1.1799999999999999 110.592 -177.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.514 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -67.21 -44.95 78.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.659 0.266 . . . . 2.5299999999999998 110.955 177.817 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.447 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 70.7 ttt180 -66.07 -34.61 78.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.579 0.704 . . . . 4.5099999999999998 109.771 174.328 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . 0.476 ' O ' HG22 ' A' ' 81' ' ' ILE . 77.6 t60 -65.83 -46.28 79.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.976 -1.011 . . . . 0.63 110.689 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.533 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 31.3 mt -74.27 -19.44 60.49 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.674 0.274 . . . . 1.26 110.803 177.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.447 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 70.4 ttt180 -60.32 -47.74 84.75 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.282 -0.417 . . . . 3.9399999999999999 109.955 176.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.476 HG22 ' O ' ' A' ' 78' ' ' HIS . 11.3 tp -72.88 -25.83 22.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.303 -0.408 . . . . 2.3599999999999999 110.36 177.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.533 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 32.3 m-70 -67.63 -41.44 83.91 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.048 0.452 . . . . 0.45000000000000001 110.683 175.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 C--N 1.325 -0.477 0 CA-C-O 121.138 0.494 . . . . 1.6499999999999999 110.352 179.786 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.584 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 67.0 mt . . . . . 0 CA--C 1.515 -0.398 0 CA-C-O 120.649 0.261 . . . . 1.2 110.676 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.491 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 11.4 tppt? -80.85 128.31 33.53 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.091 -0.504 . . . . 2.54 112.188 -171.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 41.2 t -90.9 99.29 12.35 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.577 -1.268 . . . . 0.46000000000000002 107.577 166.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -63.78 -24.82 67.92 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 111.893 0.331 . . . . 4.4000000000000004 111.893 -173.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -76.46 -30.61 57.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.677 -0.238 . . . . 2.1800000000000002 111.489 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 67.6 m -97.5 -41.54 8.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.161 0.505 . . . . 0.32000000000000001 111.141 178.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.55 6.5 50.19 Favored Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 110.827 -0.909 . . . . 0.40000000000000002 110.827 -178.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.446 ' HE3' ' HE1' ' A' ' 69' ' ' PHE . 25.1 pttt -108.07 -177.57 3.37 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 108.972 -0.751 . . . . 1.8600000000000001 108.972 -177.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.584 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 50.1 mt-30 -137.31 163.44 30.98 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 116.03 -0.532 . . . . 1.98 110.593 -174.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.53 ' CD1' HD22 ' A' ' 75' ' ' LEU . 14.1 m-85 -132.73 131.33 41.08 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-O 121.121 0.486 . . . . 0.87 110.885 -177.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.7 m -67.68 -26.69 66.32 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 114.799 -1.092 . . . . 2.1600000000000001 112.529 -174.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.4 m -114.28 130.0 56.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.108 0.48 . . . . 1.49 110.255 -178.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.485 ' HA ' HD11 ' A' ' 60' ' ' LEU . 13.2 m -56.4 -45.53 80.59 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 114.997 -1.001 . . . . 1.73 111.825 -176.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.87 -34.51 90.12 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.634 -0.793 . . . . 0.38 112.086 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.41 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 4.1 m-20 -63.05 -44.96 94.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.212 0.054 . . . . 1.8999999999999999 110.882 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.53 HD22 ' CD1' ' A' ' 69' ' ' PHE . 1.4 tm? -72.03 -38.39 69.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.847 0.356 . . . . 1.1799999999999999 110.176 -178.518 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.586 ' O ' ' HG3' ' A' ' 80' ' ' ARG . 0.1 OUTLIER -62.53 -50.7 70.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.326 -0.397 . . . . 2.5299999999999998 110.016 178.874 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -59.14 -40.97 87.17 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.627 0.727 . . . . 4.5099999999999998 110.354 175.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . 0.41 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 77.2 t60 -58.04 -42.82 86.2 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.527 -1.215 . . . . 0.63 111.119 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.469 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 53.7 mt -79.66 -19.17 49.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.174 -0.466 . . . . 1.26 111.836 -177.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.586 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 25.4 mtp180 -62.75 -41.76 99.36 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.978 -0.749 . . . . 3.9399999999999999 108.978 173.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 73.0 mt -65.61 -40.19 87.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.049 -0.978 . . . . 2.3599999999999999 110.446 176.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.469 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 31.5 m-70 -65.65 -31.89 73.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.896 -0.593 . . . . 0.45000000000000001 111.858 178.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.5 m . . . . . 0 C--N 1.324 -0.539 0 CA-C-O 120.717 0.294 . . . . 1.6499999999999999 111.069 -178.079 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.656 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 61.1 mt . . . . . 0 CA--C 1.512 -0.491 0 CA-C-O 120.976 0.417 . . . . 1.2 111.076 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.67 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 15.7 ttpt -82.32 134.2 35.26 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.261 0.553 . . . . 2.54 111.033 -175.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 49.4 t -87.27 96.57 10.39 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 108.166 -1.05 . . . . 0.46000000000000002 108.166 173.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -50.77 -37.71 43.82 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.528 0.517 . . . . 4.4000000000000004 110.877 179.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.6 mp0 -65.06 -38.77 91.88 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.426 -0.806 . . . . 2.1800000000000002 112.089 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.427 ' CB ' ' HG2' ' A' ' 67' ' ' LYS . 62.7 m -97.16 -41.16 8.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.124 0.488 . . . . 0.32000000000000001 111.544 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 105.63 0.12 39.78 Favored Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 111.087 -0.805 . . . . 0.40000000000000002 111.087 -177.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.574 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 14.8 ptmt -95.9 -178.39 4.34 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 115.064 -0.568 . . . . 1.8600000000000001 109.905 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.67 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 32.4 tt0 -149.04 143.69 26.24 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 116.12 -0.491 . . . . 1.98 110.728 -174.382 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.529 ' CD1' HD22 ' A' ' 75' ' ' LEU . 53.9 m-85 -113.61 -173.99 2.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.977 -0.556 . . . . 0.87 109.803 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.5 t -134.87 18.86 3.5 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.44 0.638 . . . . 2.1600000000000001 110.075 175.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 88.6 m -137.89 128.65 26.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 1.49 110.01 -178.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.656 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 5.3 p -64.14 -59.71 4.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.142 -0.935 . . . . 1.73 112.356 -175.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.18 -34.87 81.8 Favored Glycine 0 C--O 1.229 -0.177 0 C-N-CA 121.003 -0.618 . . . . 0.38 112.819 -177.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -65.08 -48.07 75.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.624 -0.139 . . . . 1.8999999999999999 110.624 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.529 HD22 ' CD1' ' A' ' 69' ' ' PHE . 1.5 tm? -70.09 -37.78 75.5 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.564 -0.289 . . . . 1.1799999999999999 110.446 -178.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.651 ' O ' ' HG2' ' A' ' 80' ' ' ARG . 7.8 mmpt? -61.19 -49.64 76.36 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.115 -0.328 . . . . 2.5299999999999998 110.115 177.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -60.34 -40.72 91.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.453 0.644 . . . . 4.5099999999999998 110.264 175.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . 0.413 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 74.4 t60 -56.04 -44.97 79.31 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.003 -0.998 . . . . 0.63 110.732 177.307 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.553 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 45.9 mt -80.17 -18.65 49.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.245 -0.434 . . . . 1.26 111.637 -178.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.651 ' HG2' ' O ' ' A' ' 76' ' ' LYS . 4.5 mmp_? -60.83 -45.49 94.27 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.91 -0.774 . . . . 3.9399999999999999 108.91 171.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 66.8 mt -60.15 -41.3 86.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.154 -0.93 . . . . 2.3599999999999999 109.963 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.553 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 39.6 m-70 -65.97 -15.19 62.78 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.879 -0.601 . . . . 0.45000000000000001 111.632 177.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 33.8 t . . . . . 0 C--N 1.324 -0.531 0 CA-C-O 120.827 0.346 . . . . 1.6499999999999999 110.764 179.413 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.923 ' HB3' HD11 ' A' ' 75' ' ' LEU . 75.6 mt . . . . . 0 C--O 1.219 -0.517 0 N-CA-C 109.876 -0.416 . . . . 1.2 109.876 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 10.5 tptm -127.12 127.0 43.9 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 120.897 0.379 . . . . 2.54 110.318 -178.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.731 ' SG ' ' CD2' ' A' ' 78' ' ' HIS . 0.5 OUTLIER -100.08 79.62 2.2 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 108.395 -0.965 . . . . 0.46000000000000002 108.395 -176.214 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -51.1 -36.47 40.56 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 113.176 0.806 . . . . 4.4000000000000004 113.176 -169.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.64 ' CD ' ' H ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER -65.98 -35.74 81.41 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.984 0.421 . . . . 2.1800000000000002 110.33 178.614 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 72.5 m -92.59 -40.61 10.68 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.9 -0.591 . . . . 0.32000000000000001 110.659 -176.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.9 11.48 49.77 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.718 -0.953 . . . . 0.40000000000000002 110.718 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.497 ' HE3' ' CE1' ' A' ' 69' ' ' PHE . 46.0 pttt -108.0 -176.53 3.08 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 114.913 -0.644 . . . . 1.8600000000000001 109.661 -177.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -138.36 156.45 47.59 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 115.514 -0.766 . . . . 1.98 109.707 -175.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.701 ' CD1' ' HG ' ' A' ' 75' ' ' LEU . 41.8 m-85 -123.4 164.33 19.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.983 0.42 . . . . 0.87 110.683 178.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.2 t -121.21 9.89 10.54 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.47 -0.937 . . . . 2.1600000000000001 108.47 173.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.457 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 32.0 m -137.74 127.82 25.9 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.739 -1.119 . . . . 1.49 109.956 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.9 t -71.18 -43.47 67.37 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.81 -0.632 . . . . 1.73 110.816 -177.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.2 -28.8 73.46 Favored Glycine 0 C--N 1.331 0.291 0 C-N-CA 120.907 -0.664 . . . . 0.38 112.678 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.457 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 34.3 m-20 -68.84 -51.57 39.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.456 0.17 . . . . 1.8999999999999999 110.676 177.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.923 HD11 ' HB3' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -67.46 -37.58 83.17 Favored 'General case' 0 C--O 1.223 -0.323 0 N-CA-C 109.753 -0.462 . . . . 1.1799999999999999 109.753 179.508 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.551 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -54.73 -52.64 61.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.91 0.386 . . . . 2.5299999999999998 110.765 177.417 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -63.09 -40.53 97.92 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.321 0.581 . . . . 4.5099999999999998 110.888 179.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . 0.731 ' CD2' ' SG ' ' A' ' 62' ' ' CYS . 78.0 t60 -69.5 -28.68 66.27 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.527 -0.761 . . . . 0.63 111.063 -178.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.615 ' HG ' HD22 ' A' ' 75' ' ' LEU . 79.7 mt -74.52 -28.24 60.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.92 0.391 . . . . 1.26 110.768 173.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -62.27 -42.26 99.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.018 -0.537 . . . . 3.9399999999999999 109.928 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.9 tt -76.31 -24.7 16.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 116.27 -0.423 . . . . 2.3599999999999999 110.725 176.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.559 ' NE2' ' NE2' ' A' ' 78' ' ' HIS . 11.6 m-70 -66.69 -36.51 82.67 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.795 0.331 . . . . 0.45000000000000001 110.599 174.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.6 m . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.043 0.449 . . . . 1.6499999999999999 111.085 178.196 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.491 HD13 ' HA ' ' A' ' 72' ' ' SER . 80.4 mt . . . . . 0 CA--C 1.515 -0.404 0 N-CA-C 110.195 -0.298 . . . . 1.2 110.195 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 2.4 mppt? -82.28 133.93 35.26 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.568 0.699 . . . . 2.54 111.663 -174.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.437 ' SG ' ' HB2' ' A' ' 64' ' ' GLU . 44.8 t -78.05 97.26 5.33 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 114.782 -1.099 . . . . 0.46000000000000002 108.087 170.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -56.22 -22.74 31.26 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.201 0.524 . . . . 4.4000000000000004 111.132 -177.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.437 ' HB2' ' SG ' ' A' ' 62' ' ' CYS . 16.3 mm-40 -72.44 -37.37 68.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.917 -0.583 . . . . 2.1800000000000002 111.339 177.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.406 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 89.4 m -107.77 -41.45 5.0 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.594 0.59 . . . . 0.32000000000000001 112.594 -173.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.89 -6.46 32.88 Favored Glycine 0 N--CA 1.452 -0.246 0 N-CA-C 111.416 -0.674 . . . . 0.40000000000000002 111.416 -176.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.5 ' O ' ' HA ' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -85.67 -178.17 6.57 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 122.982 0.513 . . . . 1.8600000000000001 109.655 178.961 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.508 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 20.0 pt20 -145.35 153.84 41.67 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 116.015 -0.539 . . . . 1.98 111.37 -172.254 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.5 ' CD1' HD21 ' A' ' 75' ' ' LEU . 56.9 m-85 -135.8 121.93 20.22 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.288 -0.415 . . . . 0.87 109.93 176.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.7 t -71.92 -10.81 60.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.113 0.483 . . . . 2.1600000000000001 111.083 -177.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 18.7 m -110.76 129.85 55.73 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.985 -0.552 . . . . 1.49 110.218 178.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.491 ' HA ' HD13 ' A' ' 60' ' ' LEU . 49.2 m -65.81 -41.9 91.31 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.441 -0.8 . . . . 1.73 112.306 -173.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.04 -36.02 92.73 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.057 -0.592 . . . . 0.38 112.583 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -62.99 -50.24 71.51 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.401 -0.222 . . . . 1.8999999999999999 110.401 178.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.5 HD21 ' CD1' ' A' ' 69' ' ' PHE . 1.1 tm? -68.19 -33.47 74.49 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.389 -0.369 . . . . 1.1799999999999999 110.304 -178.035 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.534 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -65.46 -51.25 61.49 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.654 0.264 . . . . 2.5299999999999998 110.459 178.045 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.476 ' HD3' ' O ' ' A' ' 77' ' ' ARG . 3.6 tmt_? -64.26 -34.49 78.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.313 0.578 . . . . 4.5099999999999998 109.445 176.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -60.37 -51.92 67.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.452 -0.794 . . . . 0.63 110.94 177.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.471 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 31.3 mt -75.28 -19.66 59.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.384 -0.371 . . . . 1.26 111.315 -179.066 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.458 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 42.7 ttm180 -55.99 -54.89 39.35 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.445 -0.576 . . . . 3.9399999999999999 109.445 171.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 45.9 mm -57.74 -40.29 74.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.68 -0.691 . . . . 2.3599999999999999 109.956 178.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.471 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 45.4 m-70 -64.01 -28.01 69.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.562 -0.744 . . . . 0.45000000000000001 112.091 178.575 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.1 m . . . . . 0 C--N 1.325 -0.49 0 CA-C-O 120.674 0.273 . . . . 1.6499999999999999 111.455 -176.061 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.521 HD12 ' HA ' ' A' ' 72' ' ' SER . 91.6 mt . . . . . 0 CA--C 1.516 -0.356 0 CA-C-O 120.947 0.403 . . . . 1.2 110.782 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.1 tppt? -82.91 140.18 32.98 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.819 -0.628 . . . . 2.54 111.526 -174.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 45.7 t -96.86 95.38 7.82 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 107.746 -1.205 . . . . 0.46000000000000002 107.746 164.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.3 ttp180 -52.17 -36.3 51.33 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 123.398 0.436 . . . . 4.4000000000000004 111.748 -177.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -71.62 -35.13 70.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.1 -0.5 . . . . 2.1800000000000002 111.355 -175.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.402 ' CB ' ' HG2' ' A' ' 67' ' ' LYS . 65.3 m -94.02 -41.48 9.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.168 0.509 . . . . 0.32000000000000001 111.364 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 103.71 6.03 44.17 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 111.205 -0.758 . . . . 0.40000000000000002 111.205 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.539 ' HE2' ' CZ ' ' A' ' 69' ' ' PHE . 11.5 ptmt -101.41 -177.31 3.4 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.101 -0.549 . . . . 1.8600000000000001 109.912 -178.286 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.405 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 35.6 tt0 -150.86 142.23 23.37 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.748 -0.66 . . . . 1.98 110.078 -168.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.627 ' CD1' HD23 ' A' ' 75' ' ' LEU . 88.1 m-85 -123.6 150.64 43.87 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-O 120.824 0.345 . . . . 0.87 111.09 -174.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.4 p -90.91 -25.26 19.9 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.164 -0.471 . . . . 2.1600000000000001 111.69 -177.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.459 HG22 ' CB ' ' A' ' 74' ' ' ASN . 0.5 OUTLIER -108.72 132.7 53.69 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.588 0.709 . . . . 1.49 110.648 -179.825 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.521 ' HA ' HD12 ' A' ' 60' ' ' LEU . 66.2 m -64.57 -43.8 92.73 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 114.763 -1.108 . . . . 1.73 111.787 -174.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.62 -33.47 86.74 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.574 -0.822 . . . . 0.38 112.326 -177.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 62.0 t30 -69.29 -40.56 77.64 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.096 -0.242 . . . . 1.8999999999999999 110.371 -179.227 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.627 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.6 tm? -76.47 -34.68 58.68 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.586 0.231 . . . . 1.1799999999999999 110.552 -179.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.566 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 8.8 mmpt? -64.85 -46.58 81.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.652 0.263 . . . . 2.5299999999999998 110.35 177.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -60.95 -41.72 96.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.694 0.759 . . . . 4.5099999999999998 109.736 174.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . 0.48 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 61.3 t60 -58.51 -46.88 85.81 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.292 -1.322 . . . . 0.63 111.23 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.555 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 28.8 mt -83.81 -18.86 36.24 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 111.919 0.34 . . . . 1.26 111.919 -176.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -61.86 -48.18 81.67 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.803 -0.443 . . . . 3.9399999999999999 109.803 174.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 13.9 tt -70.14 -29.46 39.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.3 -0.409 . . . . 2.3599999999999999 110.481 178.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.555 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 18.3 m-70 -63.65 -29.54 70.76 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.008 0.432 . . . . 0.45000000000000001 110.29 173.172 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 47.5 m . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 115.986 -0.552 . . . . 1.6499999999999999 111.126 -178.984 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.683 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 67.9 mt . . . . . 0 CA--C 1.515 -0.396 0 CA-C-O 121.07 0.462 . . . . 1.2 111.809 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 40.8 tptt -81.4 126.14 31.26 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.214 -0.903 . . . . 2.54 111.151 -172.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 28.8 t -80.39 117.29 21.01 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.721 -0.844 . . . . 0.46000000000000002 108.721 171.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -60.23 -34.97 74.42 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.661 0.615 . . . . 4.4000000000000004 112.661 -172.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -94.1 -21.59 19.02 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.64 -0.424 . . . . 2.1800000000000002 111.943 -172.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 84.3 m -99.35 -41.07 7.59 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.648 -0.421 . . . . 0.32000000000000001 111.961 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.58 2.52 58.69 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.707 -0.758 . . . . 0.40000000000000002 111.517 -177.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.663 ' HE3' ' CE1' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -90.7 -176.72 4.8 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 109.764 -0.458 . . . . 1.8600000000000001 109.764 178.429 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.683 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 4.6 pt20 -150.0 148.35 28.95 Favored 'General case' 0 C--N 1.309 -1.196 0 CA-C-N 115.898 -0.592 . . . . 1.98 111.114 -173.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.663 ' CE1' ' HE3' ' A' ' 67' ' ' LYS . 32.1 m-85 -122.44 133.29 54.62 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.315 -0.402 . . . . 0.87 111.51 -176.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.4 t -74.14 -16.28 61.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.329 0.585 . . . . 2.1600000000000001 110.32 177.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.524 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 13.1 m -109.91 128.95 55.68 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.047 -0.524 . . . . 1.49 110.136 177.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.509 ' HA ' HD12 ' A' ' 60' ' ' LEU . 42.5 t -69.16 -40.76 77.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.513 -0.767 . . . . 1.73 110.901 -176.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.36 -38.49 95.03 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.656 -0.783 . . . . 0.38 111.983 178.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.524 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 39.9 m-20 -61.05 -43.08 99.43 Favored 'General case' 0 C--O 1.221 -0.435 0 C-N-CA 121.434 -0.106 . . . . 1.8999999999999999 110.927 178.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.511 HD22 ' CD1' ' A' ' 69' ' ' PHE . 1.6 tm? -69.79 -37.37 76.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.816 0.341 . . . . 1.1799999999999999 110.267 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.528 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -66.96 -45.5 77.57 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.841 -0.344 . . . . 2.5299999999999998 110.11 179.734 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.56 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 4.9 tmt_? -64.99 -33.91 77.18 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.441 0.639 . . . . 4.5099999999999998 109.817 175.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -63.92 -43.77 94.92 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.307 -0.861 . . . . 0.63 110.616 177.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.585 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 44.1 mt -80.05 -18.59 49.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.942 0.401 . . . . 1.26 110.635 178.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.56 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 28.7 tpt180 -56.31 -47.61 78.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.021 -0.536 . . . . 3.9399999999999999 109.936 172.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 tp -74.7 -27.35 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 120.647 -0.421 . . . . 2.3599999999999999 110.606 178.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.585 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 28.5 m-70 -65.63 -26.03 67.64 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.087 0.47 . . . . 0.45000000000000001 110.955 174.153 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 56.7 m . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 115.981 -0.554 . . . . 1.6499999999999999 110.523 176.581 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.674 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 99.5 mt . . . . . 0 CA--C 1.513 -0.477 0 CA-C-O 120.631 0.253 . . . . 1.2 110.62 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -81.8 129.75 34.84 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.246 -0.434 . . . . 2.54 111.627 -172.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 19.5 t -82.5 128.77 34.6 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 108.688 -0.856 . . . . 0.46000000000000002 108.688 169.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.523 ' HA ' ' NE ' ' A' ' 63' ' ' ARG . 1.2 mmp_? -71.14 -38.88 72.23 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.109 -0.496 . . . . 4.4000000000000004 111.973 -172.217 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -90.46 -12.27 37.86 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.164 0.431 . . . . 2.1800000000000002 112.164 -174.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.425 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 99.1 m -109.67 -41.72 4.48 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.652 -0.419 . . . . 0.32000000000000001 111.703 178.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 96.19 1.3 61.12 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.513 -0.851 . . . . 0.40000000000000002 111.698 -177.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.489 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 17.9 ptmt -88.28 -177.72 5.74 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 122.816 0.446 . . . . 1.8600000000000001 110.126 179.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.674 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 57.3 mt-30 -145.14 144.11 30.72 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.733 -0.667 . . . . 1.98 111.405 -170.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.534 ' CD1' HD22 ' A' ' 75' ' ' LEU . 50.4 m-85 -123.1 135.92 54.58 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.162 -0.472 . . . . 0.87 111.454 -178.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.6 p -83.67 -4.52 58.67 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.256 -0.429 . . . . 2.1600000000000001 111.448 -178.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.48 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 28.5 m -123.76 129.64 51.38 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.981 -0.554 . . . . 1.49 109.924 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.1 t -61.11 -52.89 62.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.416 -0.811 . . . . 1.73 111.579 -175.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.95 -29.22 71.89 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.883 -0.675 . . . . 0.38 112.424 179.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.48 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 0.9 OUTLIER -66.39 -37.74 85.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.565 0.221 . . . . 1.8999999999999999 110.672 178.72 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.534 HD22 ' CD1' ' A' ' 69' ' ' PHE . 1.8 tm? -81.06 -32.01 34.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.373 -0.376 . . . . 1.1799999999999999 110.299 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.553 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -67.39 -47.0 71.61 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.754 0.279 . . . . 2.5299999999999998 111.754 179.148 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -31.74 73.09 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.9 0.857 . . . . 4.5099999999999998 109.092 176.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 72.7 t60 -65.29 -52.09 56.49 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.229 -1.35 . . . . 0.63 110.45 179.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.515 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 19.3 mt -76.28 -18.65 58.88 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.083 -0.508 . . . . 1.26 111.295 -179.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -55.44 -47.06 76.61 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.194 -0.669 . . . . 3.9399999999999999 109.194 170.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 47.7 mm -61.8 -41.57 91.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.415 -0.812 . . . . 2.3599999999999999 110.314 175.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.515 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 62.7 m-70 -70.12 -23.81 63.08 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.8 -0.637 . . . . 0.45000000000000001 112.542 -177.541 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 22.2 m . . . . . 0 C--N 1.326 -0.426 0 CA-C-O 120.908 0.385 . . . . 1.6499999999999999 111.062 -178.903 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.684 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 83.6 mt . . . . . 0 CA--C 1.516 -0.338 0 CA-C-O 120.676 0.274 . . . . 1.2 111.001 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.551 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 48.5 tptt -81.82 122.24 27.46 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.839 -0.619 . . . . 2.54 111.888 -171.062 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 42.3 t -91.73 96.9 10.68 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 107.406 -1.331 . . . . 0.46000000000000002 107.406 169.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 63' ' ' ARG . 59.7 mtt85 -57.49 -30.94 65.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.07 0.462 . . . . 4.4000000000000004 110.973 -177.361 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -69.18 -37.29 78.07 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.7 -0.682 . . . . 2.1800000000000002 110.987 -176.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . 0.443 ' HB3' ' HD3' ' A' ' 67' ' ' LYS . 67.7 m -94.57 -42.13 8.97 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 121.639 0.733 . . . . 0.32000000000000001 111.2 177.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.63 3.01 43.54 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-N 114.891 -1.05 . . . . 0.40000000000000002 111.32 -177.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.443 ' HD3' ' HB3' ' A' ' 65' ' ' CYS . 18.1 pttt -108.36 -178.24 3.55 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-O 120.886 0.374 . . . . 1.8600000000000001 110.07 -176.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.684 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 29.0 mt-30 -141.35 147.28 37.83 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.718 -0.674 . . . . 1.98 111.356 -168.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.46 ' CD1' HD22 ' A' ' 75' ' ' LEU . 54.1 m-85 -126.81 125.0 40.97 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.403 -0.362 . . . . 0.87 111.256 -176.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.7 p -68.42 -22.21 64.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.369 -0.378 . . . . 2.1600000000000001 111.877 -176.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.01 129.28 48.26 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.227 0.537 . . . . 1.49 110.644 179.223 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.545 ' O ' ' HG2' ' A' ' 76' ' ' LYS . 40.7 t -65.59 -43.77 88.68 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.283 -0.871 . . . . 1.73 111.039 -176.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.441 ' O ' ' HG3' ' A' ' 77' ' ' ARG . . . -68.72 -33.35 75.69 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.901 -0.666 . . . . 0.38 111.983 179.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -57.68 -45.14 86.0 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.347 -0.612 . . . . 1.8999999999999999 109.347 176.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.482 HD12 ' HG ' ' A' ' 79' ' ' LEU . 1.2 tm? -71.04 -31.25 67.66 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.702 -0.681 . . . . 1.1799999999999999 110.379 179.25 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.545 ' HG2' ' O ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -65.04 -50.75 65.01 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.886 0.374 . . . . 2.5299999999999998 109.999 176.851 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 73' ' ' GLY . 81.3 mtt180 -59.28 -39.19 82.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.673 0.749 . . . . 4.5099999999999998 109.573 174.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -63.18 -36.92 85.22 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.625 -1.17 . . . . 0.63 111.45 -177.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.523 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 37.1 mt -85.74 -23.85 27.16 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 122.212 -0.305 . . . . 1.26 111.242 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 46.3 ttp180 -59.11 -38.64 80.04 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.924 -0.398 . . . . 3.9399999999999999 109.924 173.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 17.2 tt -82.22 -26.15 9.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 C-N-CA 120.83 -0.348 . . . . 2.3599999999999999 110.564 178.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.523 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 13.3 m-70 -66.29 -47.19 74.42 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.801 0.334 . . . . 0.45000000000000001 110.842 175.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.4 m . . . . . 0 C--N 1.32 -0.7 0 CA-C-N 116.295 -0.411 . . . . 1.6499999999999999 110.962 -179.131 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.461 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 62.1 mt . . . . . 0 CA--C 1.512 -0.506 0 CA-C-O 121.196 0.522 . . . . 1.2 111.397 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.9 tptm -82.04 129.59 34.84 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.3 -0.864 . . . . 2.54 110.572 -174.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 47.3 t -86.39 97.07 10.24 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 108.119 -1.067 . . . . 0.46000000000000002 108.119 172.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 mtp180 -59.47 -23.77 63.01 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.721 0.296 . . . . 4.4000000000000004 111.56 -175.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -84.56 -20.97 30.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.531 -0.304 . . . . 2.1800000000000002 111.425 -178.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 55.4 m -107.2 -41.97 4.98 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.923 0.392 . . . . 0.32000000000000001 111.769 178.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.72 -3.11 42.04 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.742 -0.742 . . . . 0.40000000000000002 111.722 -179.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.42 -176.85 3.19 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 109.54 -0.541 . . . . 1.8600000000000001 109.54 178.454 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -139.81 149.89 44.05 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 116.126 -0.488 . . . . 1.98 110.492 -162.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.478 ' CD1' HD23 ' A' ' 75' ' ' LEU . 55.7 m-85 -117.27 179.76 3.95 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 116.345 -0.389 . . . . 0.87 110.476 -179.299 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 25.4 p -129.54 17.83 5.84 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.129 0.49 . . . . 2.1600000000000001 111.051 -179.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.621 ' HB ' ' CB ' ' A' ' 74' ' ' ASN . 22.7 m -141.97 129.46 21.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.92 -0.582 . . . . 1.49 109.767 -179.019 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.461 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 11.9 m -66.2 -42.08 89.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.644 -0.707 . . . . 1.73 111.296 -175.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.61 -35.42 59.21 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.449 -0.882 . . . . 0.38 111.953 177.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.621 ' CB ' ' HB ' ' A' ' 71' ' ' THR . 43.6 t-20 -58.59 -50.68 72.94 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.706 0.289 . . . . 1.8999999999999999 110.319 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.478 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.2 tm? -75.41 -32.49 60.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.112 -0.495 . . . . 1.1799999999999999 111.184 -175.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.581 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -69.7 -45.11 68.99 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.84 -0.744 . . . . 2.5299999999999998 110.186 -178.575 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 9.7 tpp180 -62.7 -33.51 75.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.758 0.79 . . . . 4.5099999999999998 109.414 174.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . 0.423 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 65.8 t60 -65.0 -39.0 92.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.421 -1.263 . . . . 0.63 110.706 177.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.486 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 54.3 mt -81.83 -23.63 36.32 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.534 -0.303 . . . . 1.26 111.808 -179.446 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -62.28 -40.09 95.1 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.678 -0.489 . . . . 3.9399999999999999 109.678 173.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.5 tt -83.25 -10.82 11.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-O 121.07 0.462 . . . . 2.3599999999999999 110.86 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.486 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 13.6 m-70 -86.35 -47.3 9.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.263 -0.426 . . . . 0.45000000000000001 110.501 173.607 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.0 m . . . . . 0 C--N 1.322 -0.619 0 CA-C-N 116.034 -0.53 . . . . 1.6499999999999999 111.056 -174.024 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 88.7 mt . . . . . 0 N--CA 1.452 -0.364 0 N-CA-C 110.309 -0.256 . . . . 1.2 110.309 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.929 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 24.4 mtmm -78.99 130.19 35.27 Favored 'General case' 0 CA--C 1.511 -0.529 0 C-N-CA 120.389 -0.524 . . . . 2.54 110.806 -175.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 35.7 t -68.35 110.29 4.03 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 108.593 -0.891 . . . . 0.46000000000000002 108.593 170.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 ttp180 -57.93 -30.43 65.94 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 123.171 0.294 . . . . 4.4000000000000004 111.741 -175.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -85.29 -26.78 26.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.57 -0.286 . . . . 2.1800000000000002 111.663 -174.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 93.6 m -103.15 -40.24 6.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.968 0.413 . . . . 0.32000000000000001 111.278 -178.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.75 -1.11 52.32 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 121.141 -0.552 . . . . 0.40000000000000002 112.043 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.95 129.86 55.44 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 122.129 0.966 . . . . 1.8600000000000001 110.739 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.929 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 3.8 pt20 -81.33 161.9 23.65 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 113.384 -1.735 . . . . 1.98 112.917 -176.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . 0.576 ' CD1' HD21 ' A' ' 75' ' ' LEU . 34.1 m-85 -130.92 131.8 44.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.702 -1.136 . . . . 0.87 109.446 176.128 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.7 t -84.05 -4.53 58.82 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.005 0.431 . . . . 2.1600000000000001 111.147 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.2 m -115.52 129.27 56.48 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.264 0.554 . . . . 1.49 110.201 179.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.8 p -65.65 -50.06 66.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.177 -0.919 . . . . 1.73 111.854 -175.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.65 -29.52 67.17 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.839 -0.696 . . . . 0.38 112.575 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.437 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 6.0 m120 -68.59 -55.02 12.98 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.327 0.108 . . . . 1.8999999999999999 110.766 176.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.576 HD21 ' CD1' ' A' ' 69' ' ' PHE . 1.1 tm? -69.82 -32.23 70.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.624 -0.262 . . . . 1.1799999999999999 111.123 -175.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.404 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 20.8 mmmt -67.68 -51.62 47.49 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.733 -0.387 . . . . 2.5299999999999998 111.328 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -64.68 -29.13 70.12 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.592 0.71 . . . . 4.5099999999999998 109.565 176.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . 0.437 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 53.3 t60 -64.44 -48.86 73.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.972 -1.013 . . . . 0.63 110.587 177.005 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.497 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 33.1 mt -79.49 -19.55 49.44 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.723 0.296 . . . . 1.26 111.04 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 -58.54 -48.68 80.06 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.062 -0.517 . . . . 3.9399999999999999 110.385 175.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.0 tt -72.3 -30.14 34.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.459 -0.337 . . . . 2.3599999999999999 110.326 178.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . 0.497 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 33.4 m-70 -64.21 -41.24 97.13 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.104 0.478 . . . . 0.45000000000000001 110.791 174.747 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 115.965 -0.561 . . . . 1.6499999999999999 110.589 179.954 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.537 ' O ' ' HA ' ' A' ' 70' ' ' THR . . . . . . . . 0 N--CA 1.481 1.649 0 CA-C-O 119.818 -0.434 . . . . 1.95 112.183 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.649 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 78.9 Cg_exo -42.94 115.09 0.5 Allowed 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 123.008 2.472 . . . . 1.6599999999999999 112.828 173.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.464 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 95.5 mt -118.48 104.55 10.8 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.812 -1.085 . . . . 1.2 110.821 176.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.2 tppt? -81.77 128.75 34.32 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.489 -0.778 . . . . 2.54 110.865 -174.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 43.2 t -91.47 101.91 14.58 Favored 'General case' 0 N--CA 1.439 -0.989 0 N-CA-C 108.617 -0.883 . . . . 0.46000000000000002 108.617 171.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -55.75 -31.92 62.97 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.602 0.564 . . . . 4.4000000000000004 111.131 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -73.14 -45.53 56.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.004 -0.544 . . . . 2.1800000000000002 111.479 -177.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.497 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 65.9 m -86.63 -41.08 14.53 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.381 0.61 . . . . 0.32000000000000001 110.712 -176.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.68 -0.56 52.61 Favored Glycine 0 N--CA 1.443 -0.891 0 N-CA-C 110.657 -0.977 . . . . 0.40000000000000002 110.657 -176.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.504 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 18.4 ptmt -92.17 -177.66 4.74 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.067 -0.567 . . . . 1.8600000000000001 109.894 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.464 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 36.1 tt0 -156.72 137.1 12.97 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.603 -0.726 . . . . 1.98 110.463 -171.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.649 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 62.3 m-85 -109.96 -174.69 2.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.226 -0.443 . . . . 0.87 110.132 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.537 ' HA ' ' O ' ' A' ' 58' ' ' GLY . 14.4 t -140.86 17.41 2.31 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.757 0.789 . . . . 2.1600000000000001 108.948 170.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 16.9 m -131.89 128.69 39.11 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.142 -0.936 . . . . 1.49 109.555 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.9 t -65.03 -52.37 56.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.982 -1.008 . . . . 1.73 112.229 -172.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.57 -40.59 98.05 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.979 -0.629 . . . . 0.38 112.899 -176.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -63.65 -47.19 82.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.618 0.209 . . . . 1.8999999999999999 111.455 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.533 HD22 ' CD1' ' A' ' 69' ' ' PHE . 1.8 tm? -72.47 -35.72 68.28 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.263 -0.273 . . . . 1.1799999999999999 110.263 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.1 mmmt -62.6 -52.72 62.26 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.956 -0.298 . . . . 2.5299999999999998 110.958 177.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -61.43 -32.36 72.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.22 0.533 . . . . 4.5099999999999998 110.215 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -65.57 -45.64 82.55 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.394 -0.821 . . . . 0.63 110.764 178.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.551 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 23.4 mt -79.77 -19.16 49.33 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.923 0.392 . . . . 1.26 110.644 -179.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 85' ' ' GLU . 32.4 ttt180 -58.8 -47.55 84.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.919 -0.582 . . . . 3.9399999999999999 109.556 173.357 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 65.4 mt -64.1 -41.28 91.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.511 -0.768 . . . . 2.3599999999999999 110.132 176.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.551 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 36.3 m-70 -60.31 -40.35 90.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.641 -0.708 . . . . 0.45000000000000001 111.741 178.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 28.4 m -84.82 -29.9 24.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.338 -0.392 . . . . 1.6499999999999999 111.572 -176.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 83.95 5.81 87.38 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.947 -0.644 . . . . 1.25 111.527 -176.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 80' ' ' ARG . 6.2 mm-40 -107.35 -171.78 1.95 Allowed 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 122.584 0.354 . . . . 3.1800000000000002 110.959 -177.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.567 ' N ' ' HD2' ' A' ' 86' ' ' LYS . 6.8 mptt . . . . . 0 C--O 1.248 0.976 0 CA-C-O 118.803 -0.618 . . . . 6.5599999999999996 109.801 -175.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.677 0 N-CA-C 111.902 -0.479 . . . . 1.95 111.902 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.599 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 88.3 Cg_exo -41.7 115.21 0.41 Allowed 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 123.423 2.749 . . . . 1.6599999999999999 113.255 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.51 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 79.6 mt -121.94 116.07 23.7 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.759 -1.109 . . . . 1.2 110.604 175.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.408 ' HD2' ' O ' ' A' ' 67' ' ' LYS . 21.5 tptm -82.11 128.85 34.54 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.552 -0.749 . . . . 2.54 111.279 -171.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 54.1 t -89.76 106.5 18.51 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 107.715 -1.217 . . . . 0.46000000000000002 107.715 171.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.4 mtm180 -64.13 -35.88 82.2 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.373 0.606 . . . . 4.4000000000000004 110.013 -175.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -68.02 -36.01 79.25 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.931 -1.031 . . . . 2.1800000000000002 111.381 -177.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 90.4 m -97.44 -42.07 7.9 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.088 0.471 . . . . 0.32000000000000001 111.834 -178.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.98 4.52 48.05 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 121.021 -0.609 . . . . 0.40000000000000002 111.622 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.408 ' O ' ' HD2' ' A' ' 61' ' ' LYS . 17.0 ptmt -103.92 -176.28 3.04 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 123.273 0.629 . . . . 1.8600000000000001 109.354 179.003 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.446 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 17.2 pt20 -148.4 151.86 35.99 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 120.799 0.333 . . . . 1.98 111.247 -174.008 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.599 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 58.8 m-85 -117.58 176.18 5.29 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 116.166 -0.47 . . . . 0.87 110.412 -176.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 76.3 p -112.81 -21.23 11.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.889 0.376 . . . . 2.1600000000000001 111.535 -177.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.6 p -112.22 134.16 53.93 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.409 0.623 . . . . 1.49 111.389 -175.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.51 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 23.3 m -64.01 -46.39 84.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.946 -1.025 . . . . 1.73 111.891 -175.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.9 -35.2 78.76 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.43 -0.89 . . . . 0.38 112.341 -177.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -68.48 -42.68 78.33 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.629 0.252 . . . . 1.8999999999999999 110.693 -176.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.526 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.4 tm? -72.51 -41.29 66.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.516 -0.311 . . . . 1.1799999999999999 110.825 -179.27 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.51 -41.84 79.4 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.269 -0.572 . . . . 2.5299999999999998 110.766 -177.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -62.15 -36.54 82.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.222 0.534 . . . . 4.5099999999999998 109.788 172.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.41 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 82.0 t60 -63.26 -47.84 80.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.376 -0.829 . . . . 0.63 111.034 177.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.471 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 35.0 mt -73.29 -19.6 61.01 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 121.197 -0.201 . . . . 1.26 111.328 -177.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.475 ' HG3' ' O ' ' A' ' 85' ' ' GLU . 73.9 ttt180 -64.91 -38.71 91.86 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.188 -0.671 . . . . 3.9399999999999999 109.188 171.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 54.8 mt -66.08 -37.14 79.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.854 -0.612 . . . . 2.3599999999999999 109.64 176.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.471 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 21.6 m-70 -67.51 -33.76 75.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.449 -0.796 . . . . 0.45000000000000001 111.658 178.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 29.2 t -90.91 -55.2 3.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.873 0.368 . . . . 1.6499999999999999 111.554 -177.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 106.08 -20.44 35.73 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 111.317 -0.713 . . . . 1.25 111.317 -173.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.475 ' O ' ' HG3' ' A' ' 80' ' ' ARG . 6.2 mm-40 -82.89 154.57 24.54 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.785 0.802 . . . . 3.1800000000000002 111.157 -177.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.307 -1.265 0 CA-C-N 114.417 -1.265 . . . . 6.5599999999999996 110.956 -172.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.792 0 CA-C-O 119.575 -0.569 . . . . 1.95 112.027 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.99 117.94 4.65 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 122.334 2.023 . . . . 1.6599999999999999 112.177 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.485 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 59.7 mt -117.84 129.03 55.41 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.366 -0.834 . . . . 1.2 110.816 176.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -82.14 131.38 35.24 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.429 -0.805 . . . . 2.54 111.758 -170.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 48.6 t -97.38 118.2 33.32 Favored 'General case' 0 N--CA 1.438 -1.057 0 N-CA-C 107.795 -1.187 . . . . 0.46000000000000002 107.795 169.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.419 ' HD3' ' H ' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -73.35 -40.45 64.41 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.199 0.523 . . . . 4.4000000000000004 110.141 -174.335 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -66.43 -36.59 83.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.133 -0.939 . . . . 2.1800000000000002 110.798 -176.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 94.2 m -92.6 -41.18 10.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.101 -0.499 . . . . 0.32000000000000001 110.987 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.56 9.89 54.22 Favored Glycine 0 N--CA 1.451 -0.315 0 N-CA-C 111.409 -0.676 . . . . 0.40000000000000002 111.409 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -110.63 -176.25 2.93 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 123.574 0.75 . . . . 1.8600000000000001 109.532 -178.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.485 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 3.8 pt20 -138.9 156.23 47.44 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 116.012 -0.54 . . . . 1.98 110.887 -177.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.634 ' CD1' HD23 ' A' ' 75' ' ' LEU . 40.1 m-85 -122.04 128.62 51.61 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.165 -0.47 . . . . 0.87 111.106 -178.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.418 HG23 ' HG1' ' A' ' 71' ' ' THR . 14.8 t -69.23 -14.93 63.24 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.977 -0.556 . . . . 2.1600000000000001 111.689 -179.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.418 ' HG1' HG23 ' A' ' 70' ' ' THR . 24.4 m -112.8 129.05 56.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.037 0.446 . . . . 1.49 110.274 -178.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.469 ' HA ' HD13 ' A' ' 60' ' ' LEU . 7.8 m -69.31 -53.63 18.72 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.401 -0.818 . . . . 1.73 112.333 -172.094 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.57 -27.87 73.54 Favored Glycine 0 CA--C 1.508 -0.366 0 C-N-CA 120.697 -0.763 . . . . 0.38 112.0 -178.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -66.47 -44.53 82.46 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.855 -0.424 . . . . 1.8999999999999999 109.855 178.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.634 HD23 ' CD1' ' A' ' 69' ' ' PHE . 2.5 tm? -67.7 -39.97 84.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.484 . . . . 1.1799999999999999 110.067 178.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.524 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 3.5 mmpt? -61.9 -43.3 99.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.873 0.368 . . . . 2.5299999999999998 110.829 177.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.448 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 41.6 ttm180 -66.57 -38.82 87.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.164 -0.471 . . . . 4.5099999999999998 110.58 175.157 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -64.02 -47.27 80.92 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.879 -0.601 . . . . 0.63 111.433 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.567 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 18.5 mt -75.09 -19.77 59.8 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 121.056 -0.257 . . . . 1.26 110.967 -178.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.448 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 0.3 OUTLIER -57.48 -46.13 84.04 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.938 -0.764 . . . . 3.9399999999999999 108.938 170.556 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 52.3 mt -68.18 -38.09 79.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.351 -0.84 . . . . 2.3599999999999999 110.545 178.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.567 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 16.5 m-70 -61.84 -31.22 71.45 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.282 -0.417 . . . . 0.45000000000000001 111.311 177.354 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.1 m -80.09 -16.91 53.99 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.083 -0.508 . . . . 1.6499999999999999 111.157 -178.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 75.84 15.81 81.08 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.965 -0.636 . . . . 1.25 112.125 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -114.1 138.56 50.25 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 109.955 -0.387 . . . . 3.1800000000000002 109.955 -177.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.52 -0.752 . . . . 6.5599999999999996 109.616 176.734 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.757 0 N-CA-C 112.094 -0.402 . . . . 1.95 112.094 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.806 ' HB2' HE21 ' A' ' 68' ' ' GLN . 29.0 Cg_endo -64.3 118.0 4.99 Favored 'Trans proline' 0 N--CA 1.454 -0.844 0 C-N-CA 121.882 1.721 . . . . 1.6599999999999999 110.603 170.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.617 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 75.0 mt -100.81 126.5 47.39 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.258 -0.883 . . . . 1.2 111.568 -175.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 36.4 tptt -81.59 117.53 22.04 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.727 -0.669 . . . . 2.54 110.929 -172.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 40.4 t -78.57 112.67 15.88 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.086 -0.709 . . . . 0.46000000000000002 109.086 174.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 63.8 ttt180 -59.95 -36.99 78.25 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.054 -0.521 . . . . 4.4000000000000004 111.43 -177.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.3 mp0 -76.52 -36.01 57.97 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.029 -0.532 . . . . 2.1800000000000002 111.79 -176.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.509 ' HB3' ' HD3' ' A' ' 67' ' ' LYS . 80.1 m -93.34 -41.34 9.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.099 0.476 . . . . 0.32000000000000001 111.584 -177.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.8 -0.75 59.43 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.539 -0.755 . . . . 0.40000000000000002 111.617 -176.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.509 ' HD3' ' HB3' ' A' ' 65' ' ' CYS . 12.2 pttt -103.72 -177.78 3.47 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 108.762 -0.829 . . . . 1.8600000000000001 108.762 178.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.806 HE21 ' HB2' ' A' ' 59' ' ' PRO . 13.4 pt20 -145.67 156.5 43.68 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 116.484 -0.325 . . . . 1.98 111.327 -170.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.577 ' CD2' HD21 ' A' ' 75' ' ' LEU . 43.6 m-85 -131.03 137.82 49.35 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-N 116.03 -0.532 . . . . 0.87 111.416 -170.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.9 m -72.6 -32.69 66.17 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.48 -0.782 . . . . 2.1600000000000001 112.011 -173.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.495 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 24.9 m -100.97 128.84 46.82 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.392 0.615 . . . . 1.49 110.379 -179.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.482 ' HA ' HD13 ' A' ' 60' ' ' LEU . 22.9 t -64.95 -44.71 88.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.211 -0.904 . . . . 1.73 110.964 -176.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.53 -31.11 79.12 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.842 -0.694 . . . . 0.38 112.088 177.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.495 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 5.2 t30 -67.75 -45.58 74.56 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.78 -0.452 . . . . 1.8999999999999999 109.78 178.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.577 HD21 ' CD2' ' A' ' 69' ' ' PHE . 1.5 tm? -68.63 -35.35 77.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.003 -0.544 . . . . 1.1799999999999999 109.698 178.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.557 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -63.15 -47.83 81.06 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.891 -0.411 . . . . 2.5299999999999998 109.891 177.861 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.483 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 7.8 tpt180 -63.69 -38.7 92.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.29 0.567 . . . . 4.5099999999999998 110.355 175.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -61.48 -41.88 97.94 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.475 -0.784 . . . . 0.63 110.502 177.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 31.6 mt -75.85 -19.56 58.8 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.27 -0.423 . . . . 1.26 111.349 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.483 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 27.3 ttt85 -61.05 -44.07 97.93 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.587 -0.523 . . . . 3.9399999999999999 109.587 173.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 48.2 mm -61.3 -46.19 97.11 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.527 -0.761 . . . . 2.3599999999999999 110.086 175.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -58.26 -43.03 87.69 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.671 -0.695 . . . . 0.45000000000000001 111.436 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 24.2 m -73.14 -31.97 64.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.144 -0.48 . . . . 1.6499999999999999 111.601 -177.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 88.44 27.01 26.24 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.673 -0.775 . . . . 1.25 111.587 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.427 ' HB2' ' HG3' ' A' ' 80' ' ' ARG . 48.1 mm-40 -82.47 127.85 33.7 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.027 0.441 . . . . 3.1800000000000002 110.583 -177.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.1 pttm . . . . . 0 C--O 1.248 1.001 0 CA-C-N 115.511 -0.768 . . . . 6.5599999999999996 109.927 173.609 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.56 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . . . . . . 0 N--CA 1.48 1.593 0 N-CA-C 111.663 -0.575 . . . . 1.95 111.663 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.646 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 74.8 Cg_exo -42.22 115.13 0.44 Allowed 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 123.266 2.644 . . . . 1.6599999999999999 112.814 177.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 58' ' ' GLY . 97.6 mt -128.9 116.55 19.58 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.868 -1.06 . . . . 1.2 111.35 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.6 tptp -81.47 132.68 35.33 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.835 -0.621 . . . . 2.54 111.112 -172.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 53.2 t -93.91 116.64 29.11 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.062 -1.088 . . . . 0.46000000000000002 108.062 171.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 46.9 mtp180 -71.9 -37.33 70.13 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.992 0.425 . . . . 4.4000000000000004 111.143 -176.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.452 ' OE2' ' HB3' ' A' ' 82' ' ' HIS . 4.5 mp0 -65.6 -35.34 80.53 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.887 -0.597 . . . . 2.1800000000000002 111.734 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 85.8 m -98.42 -40.5 8.25 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.948 0.404 . . . . 0.32000000000000001 111.512 -178.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 103.7 -6.52 48.71 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 111.442 -0.663 . . . . 0.40000000000000002 111.442 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.591 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 17.7 ptmt -90.37 -176.35 4.77 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.058 -0.571 . . . . 1.8600000000000001 110.438 -177.109 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -143.18 141.43 31.14 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.369 -0.832 . . . . 1.98 109.905 -172.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.646 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 6.6 m-85 -108.53 174.12 6.01 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 110.214 -0.291 . . . . 0.87 110.214 -177.007 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 64.8 p -119.65 -31.74 4.48 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.976 0.417 . . . . 2.1600000000000001 110.812 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.1 p -97.71 129.34 44.76 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.507 0.67 . . . . 1.49 110.815 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.48 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 20.2 p -64.87 -42.84 94.51 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.143 -0.935 . . . . 1.73 112.023 -173.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.08 -32.55 76.94 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.551 -0.833 . . . . 0.38 112.003 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -67.6 -43.65 80.01 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 121.315 -0.154 . . . . 1.8999999999999999 111.005 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.515 HD22 ' CD1' ' A' ' 69' ' ' PHE . 1.5 tm? -74.28 -35.17 63.74 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 121.04 -0.264 . . . . 1.1799999999999999 110.429 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.559 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -60.5 -55.05 38.11 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.473 0.178 . . . . 2.5299999999999998 111.309 178.384 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -62.57 -30.7 71.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.289 0.566 . . . . 4.5099999999999998 110.045 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -69.21 -43.1 74.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.331 -0.85 . . . . 0.63 111.751 -178.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.497 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 18.0 mt -79.15 -23.87 43.69 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.179 -0.609 . . . . 1.26 110.801 -178.326 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.66 ' HG3' ' HB3' ' A' ' 85' ' ' GLU . 77.5 ttt180 -58.27 -47.66 82.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.091 -0.504 . . . . 3.9399999999999999 110.324 173.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.7 tt -73.36 -32.47 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-O 120.688 0.28 . . . . 2.3599999999999999 110.682 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.497 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 6.7 m-70 -58.17 -49.86 75.55 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.061 0.458 . . . . 0.45000000000000001 110.646 174.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 24.1 m -79.06 -11.12 59.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.854 -0.612 . . . . 1.6499999999999999 111.58 -178.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.41 31.25 55.1 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.892 -0.67 . . . . 1.25 112.18 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.66 ' HB3' ' HG3' ' A' ' 80' ' ' ARG . 34.5 tt0 -74.66 105.81 5.93 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 121.157 0.503 . . . . 3.1800000000000002 109.919 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.607 ' HZ2' ' HB2' ' A' ' 86' ' ' LYS . 8.3 mtmp? . . . . . 0 C--O 1.248 1.006 0 CA-C-N 115.462 -0.79 . . . . 6.5599999999999996 110.314 -176.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.416 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . . . . . . 0 N--CA 1.482 1.711 0 CA-C-O 119.347 -0.696 . . . . 1.95 111.639 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -49.71 115.08 1.62 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.608 2.205 . . . . 1.6599999999999999 111.762 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.533 HD11 ' HA ' ' A' ' 72' ' ' SER . 36.4 mt -118.72 109.86 16.59 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.172 -0.922 . . . . 1.2 110.961 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.672 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 71.5 tttt -81.2 120.69 25.2 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.132 -0.486 . . . . 2.54 110.913 -175.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 16.9 t -69.18 127.98 35.02 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 109.171 -0.677 . . . . 0.46000000000000002 109.171 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 36.2 ttt-85 -66.52 -47.34 73.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.956 -0.566 . . . . 4.4000000000000004 111.345 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.2 mp0 -72.37 -39.53 67.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.16 -0.473 . . . . 2.1800000000000002 111.77 -174.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.411 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 89.3 m -88.82 -40.52 13.1 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.2 0.524 . . . . 0.32000000000000001 110.651 -177.259 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 93.77 8.48 60.65 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 115.213 -0.903 . . . . 0.40000000000000002 111.381 -174.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.411 ' HG2' ' HB2' ' A' ' 65' ' ' CYS . 0.0 OUTLIER -109.41 129.76 55.53 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 122.04 0.924 . . . . 1.8600000000000001 110.829 -175.727 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.672 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 14.5 mt-30 -86.62 147.78 25.76 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 113.826 -1.534 . . . . 1.98 112.218 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.559 ' CD1' HD22 ' A' ' 75' ' ' LEU . 24.8 m-85 -118.31 127.35 53.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.398 -0.819 . . . . 0.87 110.077 177.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.7 t -74.22 -18.78 60.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.812 0.339 . . . . 2.1600000000000001 110.656 -178.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.8 m -101.74 127.94 48.28 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.538 -0.541 . . . . 1.49 109.538 176.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.533 ' HA ' HD11 ' A' ' 60' ' ' LEU . 14.1 m -70.52 -44.12 68.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.73 -0.668 . . . . 1.73 111.756 -172.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.502 ' O ' ' HG2' ' A' ' 77' ' ' ARG . . . -65.26 -36.73 93.15 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.567 -0.825 . . . . 0.38 112.234 178.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.7 -48.8 78.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.706 0.289 . . . . 1.8999999999999999 110.407 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.559 HD22 ' CD1' ' A' ' 69' ' ' PHE . 2.2 tm? -67.31 -35.27 79.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.085 -0.507 . . . . 1.1799999999999999 110.369 -179.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.576 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -65.89 -45.42 82.1 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 110.234 -0.284 . . . . 2.5299999999999998 110.234 179.787 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.655 ' O ' ' HG2' ' A' ' 80' ' ' ARG . 23.7 mmt180 -62.35 -41.83 98.9 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.493 0.663 . . . . 4.5099999999999998 109.515 173.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -58.27 -44.82 88.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.026 -0.988 . . . . 0.63 111.463 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.468 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 18.7 mt -79.61 -25.91 41.35 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.417 0.525 . . . . 1.26 112.417 -176.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.655 ' HG2' ' O ' ' A' ' 77' ' ' ARG . 12.5 ptm180 -70.24 -18.7 63.15 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.204 -0.598 . . . . 3.9399999999999999 109.461 177.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 77' ' ' ARG . 41.0 mm -81.12 -32.45 12.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.124 -0.695 . . . . 2.3599999999999999 109.124 171.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.468 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 20.6 m-70 -68.83 -41.2 78.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.077 -0.965 . . . . 0.45000000000000001 111.33 178.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.3 p -82.95 -26.69 31.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.068 0.461 . . . . 1.6499999999999999 111.091 178.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 93.36 8.24 61.38 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.91 -0.662 . . . . 1.25 111.854 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -81.64 92.82 6.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.155 0.502 . . . . 3.1800000000000002 110.83 -178.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.604 -0.712 . . . . 6.5599999999999996 109.454 175.383 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.424 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . . . . . . 0 N--CA 1.48 1.617 0 CA-C-O 119.637 -0.535 . . . . 1.95 112.273 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.427 ' HB3' ' NE2' ' A' ' 68' ' ' GLN . 62.5 Cg_exo -35.76 116.11 0.12 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 124.259 3.306 . . . . 1.6599999999999999 113.948 -178.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.509 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 83.6 mt -121.27 105.19 10.33 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.719 -1.128 . . . . 1.2 110.557 175.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -82.26 127.88 33.63 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.19 -0.914 . . . . 2.54 111.481 -172.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 52.5 t -88.48 106.9 18.58 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 108.578 -0.897 . . . . 0.46000000000000002 108.578 170.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -63.01 -30.11 71.35 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.133 -0.485 . . . . 4.4000000000000004 111.648 -174.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -85.32 -26.28 26.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.301 -0.409 . . . . 2.1800000000000002 111.461 -174.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 79.8 m -99.68 -42.58 6.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.04 0.447 . . . . 0.32000000000000001 111.666 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.36 -10.04 42.52 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.269 -0.732 . . . . 0.40000000000000002 111.269 -176.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.499 ' HE3' ' CZ ' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -81.22 -178.11 6.77 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 121.088 0.47 . . . . 1.8600000000000001 110.099 179.834 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.478 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 27.7 tt0 -160.34 141.22 11.99 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 115.311 -0.859 . . . . 1.98 110.378 -172.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.499 ' CZ ' ' HE3' ' A' ' 67' ' ' LYS . 96.1 m-85 -118.41 172.65 7.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.853 0.358 . . . . 0.87 111.425 -175.011 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.2 t -119.46 -10.53 9.65 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.549 0.69 . . . . 2.1600000000000001 109.243 172.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 22.8 m -99.13 128.84 45.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.734 -0.667 . . . . 1.49 110.031 177.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.509 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 14.0 m -70.61 -51.13 30.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.611 -0.722 . . . . 1.73 111.419 -174.266 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.42 ' O ' ' HG3' ' A' ' 77' ' ' ARG . . . -62.33 -33.95 87.74 Favored Glycine 0 CA--C 1.51 -0.276 0 C-N-CA 120.867 -0.682 . . . . 0.38 112.631 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -60.8 -54.48 44.64 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.908 -0.404 . . . . 1.8999999999999999 109.908 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.45 ' HG ' ' HB3' ' A' ' 60' ' ' LEU . 1.5 tm? -70.21 -32.14 69.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.842 0.353 . . . . 1.1799999999999999 110.923 -177.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.44 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -66.64 -44.98 80.5 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.411 -0.516 . . . . 2.5299999999999998 110.6 -178.741 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.42 ' HG3' ' O ' ' A' ' 73' ' ' GLY . 24.4 mtm-85 -69.4 -33.07 72.45 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.462 0.649 . . . . 4.5099999999999998 109.823 175.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 56.6 t60 -58.5 -51.63 69.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.961 -1.018 . . . . 0.63 110.465 176.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.558 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 32.8 mt -75.57 -18.92 59.61 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.177 -0.465 . . . . 1.26 111.109 178.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.471 ' HA ' ' HG2' ' A' ' 85' ' ' GLU . 49.8 ttp180 -58.01 -48.29 80.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.308 -0.405 . . . . 3.9399999999999999 109.966 177.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 38.5 pt -77.22 -25.4 15.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 2.3599999999999999 110.981 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.558 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 21.9 m-70 -65.44 -47.31 76.61 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.831 0.348 . . . . 0.45000000000000001 111.195 176.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.2 m -89.6 -23.82 21.85 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.233 -0.44 . . . . 1.6499999999999999 111.405 -177.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 81.98 26.13 50.15 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.886 -0.673 . . . . 1.25 111.931 -178.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.471 ' HG2' ' HA ' ' A' ' 80' ' ' ARG . 7.6 pt-20 -74.57 115.61 14.32 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.274 0.559 . . . . 3.1800000000000002 111.697 -174.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 60.5 mttp . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.54 -0.743 . . . . 6.5599999999999996 109.546 172.188 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.666 0 CA-C-O 119.761 -0.466 . . . . 1.95 112.232 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.651 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 9.6 Cg_endo -50.79 116.04 2.36 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 123.001 2.467 . . . . 1.6599999999999999 112.594 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 87.9 mt -132.01 120.79 22.91 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.862 -1.063 . . . . 1.2 111.144 176.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.65 ' HD2' ' HB3' ' A' ' 68' ' ' GLN . 2.5 mptm? -80.39 129.95 34.85 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.324 -0.398 . . . . 2.54 111.053 -176.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 37.1 t -75.33 114.55 13.99 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.711 -0.848 . . . . 0.46000000000000002 108.711 170.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 63' ' ' ARG . 23.7 ttt180 -53.73 -46.13 70.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.402 -0.817 . . . . 4.4000000000000004 112.119 -176.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 30.1 mp0 -75.87 -31.36 59.23 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.106 -0.497 . . . . 2.1800000000000002 112.009 -174.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 91.6 m -98.27 -40.47 8.33 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.231 0.456 . . . . 0.32000000000000001 112.231 -174.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 100.43 -0.92 55.75 Favored Glycine 0 N--CA 1.455 -0.098 0 C-N-CA 120.874 -0.679 . . . . 0.40000000000000002 111.824 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.471 ' O ' ' HA ' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -93.1 -175.7 3.94 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 109.303 -0.629 . . . . 1.8600000000000001 109.303 179.171 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.65 ' HB3' ' HD2' ' A' ' 61' ' ' LYS . 20.6 pt20 -141.38 150.21 42.11 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.001 0.429 . . . . 1.98 111.703 -171.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.651 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 58.6 m-85 -118.94 177.42 4.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.827 -0.624 . . . . 0.87 109.825 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.4 p -120.26 0.35 10.61 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.171 0.51 . . . . 2.1600000000000001 111.146 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.627 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 8.3 m -126.71 130.02 49.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.876 -0.602 . . . . 1.49 110.163 -175.314 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.411 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 49.6 m -63.23 -51.25 67.0 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.597 -0.729 . . . . 1.73 111.646 -177.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.4 -28.6 73.16 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.854 -0.689 . . . . 0.38 111.873 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.627 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 41.3 t-20 -64.58 -50.67 66.33 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.705 -0.48 . . . . 1.8999999999999999 109.705 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.552 HD21 ' CD1' ' A' ' 69' ' ' PHE . 1.3 tm? -65.78 -38.87 90.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.31 -0.405 . . . . 1.1799999999999999 110.377 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.8 mmmt -66.04 -47.9 72.86 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.831 -0.348 . . . . 2.5299999999999998 111.18 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.414 ' O ' HG13 ' A' ' 81' ' ' ILE . 42.8 ttm180 -60.06 -41.57 92.65 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.234 0.54 . . . . 4.5099999999999998 109.829 175.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -59.97 -45.03 94.02 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.135 -0.939 . . . . 0.63 111.273 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.598 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 34.1 mt -78.04 -19.54 54.13 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.666 -0.414 . . . . 1.26 110.952 -176.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -69.58 -33.08 72.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.03 -0.73 . . . . 3.9399999999999999 109.03 172.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 77' ' ' ARG . 70.7 mt -75.67 -32.06 23.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.392 -0.822 . . . . 2.3599999999999999 110.024 174.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.598 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 6.1 m-70 -65.53 -37.54 87.03 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.166 -0.47 . . . . 0.45000000000000001 111.375 176.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 51.8 p -83.77 -28.44 28.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.085 0.469 . . . . 1.6499999999999999 110.68 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 92.77 15.97 50.4 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.842 -0.694 . . . . 1.25 112.141 177.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -80.36 123.4 27.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.056 0.455 . . . . 3.1800000000000002 110.496 -178.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 49.9 tttp . . . . . 0 C--O 1.246 0.902 0 CA-C-N 115.393 -0.821 . . . . 6.5599999999999996 110.265 -179.306 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.597 0 CA-C-O 119.593 -0.559 . . . . 1.95 112.082 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_exo -38.75 117.73 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 124.035 3.157 . . . . 1.6599999999999999 114.635 -177.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.468 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 95.8 mt -121.0 92.59 3.79 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.116 -1.402 . . . . 1.2 108.299 171.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.752 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 51.8 tttp -80.63 126.23 31.0 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.462 0.649 . . . . 2.54 112.501 -162.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 51.2 t -82.32 105.58 13.51 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 115.141 -0.936 . . . . 0.46000000000000002 108.514 174.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -62.91 -29.31 70.68 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.776 0.322 . . . . 4.4000000000000004 111.198 -176.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -79.4 -30.86 42.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.91 0.337 . . . . 2.1800000000000002 111.91 -176.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 67.0 m -94.91 -41.94 8.93 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.461 0.648 . . . . 0.32000000000000001 110.679 176.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.05 -12.1 34.26 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.092 -0.958 . . . . 0.40000000000000002 111.437 -177.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.555 ' HD2' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -110.83 128.78 55.9 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 122.399 1.095 . . . . 1.8600000000000001 111.451 -177.048 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.752 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -78.73 164.34 24.65 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 113.333 -1.758 . . . . 1.98 112.75 174.781 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -122.25 143.71 49.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.973 -1.012 . . . . 0.87 110.356 176.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.0 t -91.65 7.03 43.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.075 0.464 . . . . 2.1600000000000001 110.735 177.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.445 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 3.9 m -126.22 129.57 49.23 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.735 -0.468 . . . . 1.49 109.735 179.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.468 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 22.8 t -69.51 -50.76 42.13 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.621 -0.718 . . . . 1.73 111.733 -172.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.2 -34.94 90.74 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.51 -0.852 . . . . 0.38 111.833 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.445 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 4.7 m-20 -62.11 -50.75 70.67 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.576 -0.157 . . . . 1.8999999999999999 110.576 178.077 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.451 HD23 ' O ' ' A' ' 75' ' ' LEU . 0.6 OUTLIER -68.97 -37.01 78.54 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 123.162 0.288 . . . . 1.1799999999999999 110.796 -177.489 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.535 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -62.44 -52.26 64.24 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.67 -0.412 . . . . 2.5299999999999998 110.47 178.272 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 77' ' ' ARG . 27.9 mtp180 -62.94 -30.4 71.53 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.427 0.632 . . . . 4.5099999999999998 110.414 176.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.416 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 69.8 t60 -66.32 -50.81 62.35 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.946 -1.024 . . . . 0.63 110.695 178.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.552 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 42.8 mt -75.92 -19.73 58.55 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.769 0.319 . . . . 1.26 110.807 179.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -58.93 -49.58 77.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.96 -0.564 . . . . 3.9399999999999999 109.798 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.0 tp -73.78 -30.38 28.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.037 -0.529 . . . . 2.3599999999999999 110.47 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.552 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 22.9 m-70 -61.84 -46.44 89.44 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.698 0.285 . . . . 0.45000000000000001 111.109 176.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.3 m -80.73 -13.91 58.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.027 -0.533 . . . . 1.6499999999999999 111.252 -176.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.69 29.38 57.74 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.987 -0.625 . . . . 1.25 112.17 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -104.32 152.4 22.29 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 121.16 0.505 . . . . 3.1800000000000002 109.774 -177.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt . . . . . 0 C--N 1.31 -1.135 0 CA-C-N 115.335 -0.848 . . . . 6.5599999999999996 110.442 -179.171 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.576 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . . . . . . 0 N--CA 1.483 1.781 0 CA-C-O 119.31 -0.717 . . . . 1.95 111.948 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.624 ' HB3' ' NE2' ' A' ' 68' ' ' GLN . 59.5 Cg_exo -40.36 115.83 0.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 123.003 2.469 . . . . 1.6599999999999999 112.825 176.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' A' ' 58' ' ' GLY . 96.6 mt -113.67 110.72 20.66 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.497 -0.774 . . . . 1.2 111.167 -179.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 45.5 tptt -81.92 114.03 20.24 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.325 -0.852 . . . . 2.54 109.89 -176.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 41.8 t -70.75 109.53 5.01 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.43 -0.582 . . . . 0.46000000000000002 109.43 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -58.41 -27.3 64.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.802 -0.636 . . . . 4.4000000000000004 111.483 -177.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -93.43 -20.05 20.69 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.747 0.647 . . . . 2.1800000000000002 112.747 -175.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.427 ' HB3' ' HG3' ' A' ' 67' ' ' LYS . 64.4 m -105.87 -41.37 5.43 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.211 0.448 . . . . 0.32000000000000001 112.211 178.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.91 -0.08 59.02 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.44 -0.886 . . . . 0.40000000000000002 111.565 -175.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.444 ' HE3' ' CE1' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -108.09 -178.36 3.59 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 109.182 -0.673 . . . . 1.8600000000000001 109.182 176.104 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.624 ' NE2' ' HB3' ' A' ' 59' ' ' PRO . 27.6 tt0 -141.68 148.92 39.88 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 111.763 0.283 . . . . 1.98 111.763 -159.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.459 ' CD1' HD22 ' A' ' 75' ' ' LEU . 66.5 m-85 -126.19 140.52 52.49 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 120.815 0.341 . . . . 0.87 111.229 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.2 p -84.72 -22.25 29.8 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.281 -0.418 . . . . 2.1600000000000001 111.406 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 4.6 m -104.72 129.9 52.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.853 -0.612 . . . . 1.49 110.411 -177.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.41 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.6 m -60.59 -47.87 84.28 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.343 -0.844 . . . . 1.73 111.857 -176.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.25 -32.97 85.95 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.934 -0.65 . . . . 0.38 112.431 -179.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.418 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 5.4 m-20 -62.24 -46.36 89.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.537 0.208 . . . . 1.8999999999999999 110.873 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.459 HD22 ' CD1' ' A' ' 69' ' ' PHE . 2.1 tm? -77.18 -31.8 55.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.545 -0.298 . . . . 1.1799999999999999 110.592 -177.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.514 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -67.21 -44.95 78.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.659 0.266 . . . . 2.5299999999999998 110.955 177.817 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.447 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 70.7 ttt180 -66.07 -34.61 78.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.579 0.704 . . . . 4.5099999999999998 109.771 174.328 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.476 ' O ' HG22 ' A' ' 81' ' ' ILE . 77.6 t60 -65.83 -46.28 79.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.976 -1.011 . . . . 0.63 110.689 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.533 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 31.3 mt -74.27 -19.44 60.49 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.674 0.274 . . . . 1.26 110.803 177.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.447 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 70.4 ttt180 -60.32 -47.74 84.75 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.282 -0.417 . . . . 3.9399999999999999 109.955 176.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.476 HG22 ' O ' ' A' ' 78' ' ' HIS . 11.3 tp -72.88 -25.83 22.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.303 -0.408 . . . . 2.3599999999999999 110.36 177.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.533 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 32.3 m-70 -67.63 -41.44 83.91 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.048 0.452 . . . . 0.45000000000000001 110.683 175.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.0 m -76.6 -24.26 53.45 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.138 0.494 . . . . 1.6499999999999999 110.352 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 90.75 18.76 46.6 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.967 -0.635 . . . . 1.25 112.156 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -84.21 123.17 29.82 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.134 0.492 . . . . 3.1800000000000002 110.5 -176.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp . . . . . 0 C--O 1.25 1.104 0 CA-C-N 115.404 -0.816 . . . . 6.5599999999999996 110.433 -179.198 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.688 0 CA-C-O 119.817 -0.435 . . . . 1.95 112.116 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -56.29 115.87 2.78 Favored 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 122.511 2.141 . . . . 1.6599999999999999 112.65 -176.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.584 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 67.0 mt -107.92 134.51 50.74 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.348 -0.842 . . . . 1.2 110.676 176.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.491 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 11.4 tppt? -80.85 128.31 33.53 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.091 -0.504 . . . . 2.54 112.188 -171.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 41.2 t -90.9 99.29 12.35 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.577 -1.268 . . . . 0.46000000000000002 107.577 166.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -63.78 -24.82 67.92 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 111.893 0.331 . . . . 4.4000000000000004 111.893 -173.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -76.46 -30.61 57.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.677 -0.238 . . . . 2.1800000000000002 111.489 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 67.6 m -97.5 -41.54 8.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.161 0.505 . . . . 0.32000000000000001 111.141 178.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.55 6.5 50.19 Favored Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 110.827 -0.909 . . . . 0.40000000000000002 110.827 -178.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.446 ' HE3' ' HE1' ' A' ' 69' ' ' PHE . 25.1 pttt -108.07 -177.57 3.37 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 108.972 -0.751 . . . . 1.8600000000000001 108.972 -177.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.584 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 50.1 mt-30 -137.31 163.44 30.98 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 116.03 -0.532 . . . . 1.98 110.593 -174.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.53 ' CD1' HD22 ' A' ' 75' ' ' LEU . 14.1 m-85 -132.73 131.33 41.08 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-O 121.121 0.486 . . . . 0.87 110.885 -177.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.7 m -67.68 -26.69 66.32 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 114.799 -1.092 . . . . 2.1600000000000001 112.529 -174.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.4 m -114.28 130.0 56.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.108 0.48 . . . . 1.49 110.255 -178.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.485 ' HA ' HD11 ' A' ' 60' ' ' LEU . 13.2 m -56.4 -45.53 80.59 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 114.997 -1.001 . . . . 1.73 111.825 -176.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.87 -34.51 90.12 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.634 -0.793 . . . . 0.38 112.086 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.41 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 4.1 m-20 -63.05 -44.96 94.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.212 0.054 . . . . 1.8999999999999999 110.882 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.53 HD22 ' CD1' ' A' ' 69' ' ' PHE . 1.4 tm? -72.03 -38.39 69.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.847 0.356 . . . . 1.1799999999999999 110.176 -178.518 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.586 ' O ' ' HG3' ' A' ' 80' ' ' ARG . 0.1 OUTLIER -62.53 -50.7 70.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.326 -0.397 . . . . 2.5299999999999998 110.016 178.874 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -59.14 -40.97 87.17 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.627 0.727 . . . . 4.5099999999999998 110.354 175.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.41 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 77.2 t60 -58.04 -42.82 86.2 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.527 -1.215 . . . . 0.63 111.119 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.469 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 53.7 mt -79.66 -19.17 49.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.174 -0.466 . . . . 1.26 111.836 -177.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.586 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 25.4 mtp180 -62.75 -41.76 99.36 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.978 -0.749 . . . . 3.9399999999999999 108.978 173.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 73.0 mt -65.61 -40.19 87.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.049 -0.978 . . . . 2.3599999999999999 110.446 176.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.469 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 31.5 m-70 -65.65 -31.89 73.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.896 -0.593 . . . . 0.45000000000000001 111.858 178.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.5 m -83.93 -58.52 2.75 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.717 0.294 . . . . 1.6499999999999999 111.069 -178.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.523 ' O ' ' HE2' ' A' ' 86' ' ' LYS . . . 139.7 -40.06 1.45 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.714 -0.755 . . . . 1.25 111.738 -178.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -74.16 98.57 3.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.113 0.482 . . . . 3.1800000000000002 110.445 176.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.523 ' HE2' ' O ' ' A' ' 84' ' ' GLY . 26.0 mtmt . . . . . 0 C--O 1.249 1.056 0 CA-C-N 115.46 -0.791 . . . . 6.5599999999999996 109.741 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.445 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . . . . . . 0 N--CA 1.481 1.687 0 CA-C-O 119.617 -0.546 . . . . 1.95 111.989 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.747 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 8.1 Cg_endo -49.61 116.12 2.17 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.052 2.501 . . . . 1.6599999999999999 112.53 -178.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.656 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 61.1 mt -127.21 107.57 10.13 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.91 -1.041 . . . . 1.2 111.076 179.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.67 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 15.7 ttpt -82.32 134.2 35.26 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.261 0.553 . . . . 2.54 111.033 -175.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 49.4 t -87.27 96.57 10.39 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 108.166 -1.05 . . . . 0.46000000000000002 108.166 173.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -50.77 -37.71 43.82 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.528 0.517 . . . . 4.4000000000000004 110.877 179.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.6 mp0 -65.06 -38.77 91.88 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.426 -0.806 . . . . 2.1800000000000002 112.089 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.427 ' CB ' ' HG2' ' A' ' 67' ' ' LYS . 62.7 m -97.16 -41.16 8.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.124 0.488 . . . . 0.32000000000000001 111.544 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 105.63 0.12 39.78 Favored Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 111.087 -0.805 . . . . 0.40000000000000002 111.087 -177.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.574 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 14.8 ptmt -95.9 -178.39 4.34 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 115.064 -0.568 . . . . 1.8600000000000001 109.905 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.67 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 32.4 tt0 -149.04 143.69 26.24 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 116.12 -0.491 . . . . 1.98 110.728 -174.382 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.747 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 53.9 m-85 -113.61 -173.99 2.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.977 -0.556 . . . . 0.87 109.803 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.5 t -134.87 18.86 3.5 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.44 0.638 . . . . 2.1600000000000001 110.075 175.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 88.6 m -137.89 128.65 26.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 1.49 110.01 -178.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.656 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 5.3 p -64.14 -59.71 4.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.142 -0.935 . . . . 1.73 112.356 -175.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.18 -34.87 81.8 Favored Glycine 0 C--O 1.229 -0.177 0 C-N-CA 121.003 -0.618 . . . . 0.38 112.819 -177.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -65.08 -48.07 75.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.624 -0.139 . . . . 1.8999999999999999 110.624 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.529 HD22 ' CD1' ' A' ' 69' ' ' PHE . 1.5 tm? -70.09 -37.78 75.5 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.564 -0.289 . . . . 1.1799999999999999 110.446 -178.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.651 ' O ' ' HG2' ' A' ' 80' ' ' ARG . 7.8 mmpt? -61.19 -49.64 76.36 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.115 -0.328 . . . . 2.5299999999999998 110.115 177.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -60.34 -40.72 91.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.453 0.644 . . . . 4.5099999999999998 110.264 175.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.413 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 74.4 t60 -56.04 -44.97 79.31 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.003 -0.998 . . . . 0.63 110.732 177.307 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.553 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 45.9 mt -80.17 -18.65 49.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.245 -0.434 . . . . 1.26 111.637 -178.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.651 ' HG2' ' O ' ' A' ' 76' ' ' LYS . 4.5 mmp_? -60.83 -45.49 94.27 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.91 -0.774 . . . . 3.9399999999999999 108.91 171.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 66.8 mt -60.15 -41.3 86.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.154 -0.93 . . . . 2.3599999999999999 109.963 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.553 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 39.6 m-70 -65.97 -15.19 62.78 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.879 -0.601 . . . . 0.45000000000000001 111.632 177.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 33.8 t -101.8 -0.19 34.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.827 0.346 . . . . 1.6499999999999999 110.764 179.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.1 26.31 64.52 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.898 -0.667 . . . . 1.25 112.673 179.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -73.9 96.1 2.56 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.152 0.501 . . . . 3.1800000000000002 110.48 178.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 55.0 tttp . . . . . 0 C--O 1.245 0.838 0 CA-C-N 115.272 -0.877 . . . . 6.5599999999999996 109.717 -179.818 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.414 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . . . . . . 0 N--CA 1.482 1.748 0 CA-C-O 119.414 -0.659 . . . . 1.95 112.166 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.485 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 83.3 Cg_exo -45.48 116.59 1.38 Allowed 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.862 2.375 . . . . 1.6599999999999999 112.654 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.923 ' HB3' HD11 ' A' ' 75' ' ' LEU . 75.6 mt -132.24 163.83 27.74 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.101 -0.954 . . . . 1.2 109.876 178.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 10.5 tptm -127.12 127.0 43.9 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 120.897 0.379 . . . . 2.54 110.318 -178.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.731 ' SG ' ' CD2' ' A' ' 78' ' ' HIS . 0.5 OUTLIER -100.08 79.62 2.2 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 108.395 -0.965 . . . . 0.46000000000000002 108.395 -176.214 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -51.1 -36.47 40.56 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 113.176 0.806 . . . . 4.4000000000000004 113.176 -169.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.64 ' CD ' ' H ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER -65.98 -35.74 81.41 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.984 0.421 . . . . 2.1800000000000002 110.33 178.614 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 72.5 m -92.59 -40.61 10.68 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.9 -0.591 . . . . 0.32000000000000001 110.659 -176.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.9 11.48 49.77 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.718 -0.953 . . . . 0.40000000000000002 110.718 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.497 ' HE3' ' CE1' ' A' ' 69' ' ' PHE . 46.0 pttt -108.0 -176.53 3.08 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 114.913 -0.644 . . . . 1.8600000000000001 109.661 -177.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -138.36 156.45 47.59 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 115.514 -0.766 . . . . 1.98 109.707 -175.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.701 ' CD1' ' HG ' ' A' ' 75' ' ' LEU . 41.8 m-85 -123.4 164.33 19.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.983 0.42 . . . . 0.87 110.683 178.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.2 t -121.21 9.89 10.54 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.47 -0.937 . . . . 2.1600000000000001 108.47 173.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.457 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 32.0 m -137.74 127.82 25.9 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.739 -1.119 . . . . 1.49 109.956 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.9 t -71.18 -43.47 67.37 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.81 -0.632 . . . . 1.73 110.816 -177.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.2 -28.8 73.46 Favored Glycine 0 C--N 1.331 0.291 0 C-N-CA 120.907 -0.664 . . . . 0.38 112.678 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.457 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 34.3 m-20 -68.84 -51.57 39.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.456 0.17 . . . . 1.8999999999999999 110.676 177.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.923 HD11 ' HB3' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -67.46 -37.58 83.17 Favored 'General case' 0 C--O 1.223 -0.323 0 N-CA-C 109.753 -0.462 . . . . 1.1799999999999999 109.753 179.508 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.551 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -54.73 -52.64 61.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.91 0.386 . . . . 2.5299999999999998 110.765 177.417 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -63.09 -40.53 97.92 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.321 0.581 . . . . 4.5099999999999998 110.888 179.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.731 ' CD2' ' SG ' ' A' ' 62' ' ' CYS . 78.0 t60 -69.5 -28.68 66.27 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.527 -0.761 . . . . 0.63 111.063 -178.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.615 ' HG ' HD22 ' A' ' 75' ' ' LEU . 79.7 mt -74.52 -28.24 60.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.92 0.391 . . . . 1.26 110.768 173.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -62.27 -42.26 99.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.018 -0.537 . . . . 3.9399999999999999 109.928 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.9 tt -76.31 -24.7 16.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 116.27 -0.423 . . . . 2.3599999999999999 110.725 176.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.559 ' NE2' ' NE2' ' A' ' 78' ' ' HIS . 11.6 m-70 -66.69 -36.51 82.67 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.795 0.331 . . . . 0.45000000000000001 110.599 174.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.6 m -85.49 -25.81 26.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.043 0.449 . . . . 1.6499999999999999 111.085 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 73.67 29.05 64.07 Favored Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.64 -0.709 . . . . 1.25 112.595 176.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -122.1 173.03 7.82 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.93 0.395 . . . . 3.1800000000000002 110.71 -176.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.579 ' HZ1' ' HB2' ' A' ' 86' ' ' LYS . 9.9 mtmp? . . . . . 0 C--O 1.249 1.043 0 CA-C-N 115.505 -0.77 . . . . 6.5599999999999996 110.364 177.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.598 0 N-CA-C 111.894 -0.482 . . . . 1.95 111.894 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.563 ' HB3' ' NE2' ' A' ' 68' ' ' GLN . 48.2 Cg_exo -57.63 115.02 2.22 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.507 2.138 . . . . 1.6599999999999999 112.878 -173.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.491 HD13 ' HA ' ' A' ' 72' ' ' SER . 80.4 mt -109.31 116.35 31.7 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 114.943 -1.026 . . . . 1.2 110.195 176.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 2.4 mppt? -82.28 133.93 35.26 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.568 0.699 . . . . 2.54 111.663 -174.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.437 ' SG ' ' HB2' ' A' ' 64' ' ' GLU . 44.8 t -78.05 97.26 5.33 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 114.782 -1.099 . . . . 0.46000000000000002 108.087 170.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -56.22 -22.74 31.26 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.201 0.524 . . . . 4.4000000000000004 111.132 -177.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.437 ' HB2' ' SG ' ' A' ' 62' ' ' CYS . 16.3 mm-40 -72.44 -37.37 68.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.917 -0.583 . . . . 2.1800000000000002 111.339 177.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.406 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 89.4 m -107.77 -41.45 5.0 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.594 0.59 . . . . 0.32000000000000001 112.594 -173.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.89 -6.46 32.88 Favored Glycine 0 N--CA 1.452 -0.246 0 N-CA-C 111.416 -0.674 . . . . 0.40000000000000002 111.416 -176.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.5 ' O ' ' HA ' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -85.67 -178.17 6.57 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 122.982 0.513 . . . . 1.8600000000000001 109.655 178.961 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.563 ' NE2' ' HB3' ' A' ' 59' ' ' PRO . 20.0 pt20 -145.35 153.84 41.67 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 116.015 -0.539 . . . . 1.98 111.37 -172.254 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.5 ' CD1' HD21 ' A' ' 75' ' ' LEU . 56.9 m-85 -135.8 121.93 20.22 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.288 -0.415 . . . . 0.87 109.93 176.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.7 t -71.92 -10.81 60.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.113 0.483 . . . . 2.1600000000000001 111.083 -177.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 18.7 m -110.76 129.85 55.73 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.985 -0.552 . . . . 1.49 110.218 178.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.491 ' HA ' HD13 ' A' ' 60' ' ' LEU . 49.2 m -65.81 -41.9 91.31 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.441 -0.8 . . . . 1.73 112.306 -173.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.04 -36.02 92.73 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.057 -0.592 . . . . 0.38 112.583 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -62.99 -50.24 71.51 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.401 -0.222 . . . . 1.8999999999999999 110.401 178.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.5 HD21 ' CD1' ' A' ' 69' ' ' PHE . 1.1 tm? -68.19 -33.47 74.49 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.389 -0.369 . . . . 1.1799999999999999 110.304 -178.035 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.534 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -65.46 -51.25 61.49 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.654 0.264 . . . . 2.5299999999999998 110.459 178.045 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.476 ' HD3' ' O ' ' A' ' 77' ' ' ARG . 3.6 tmt_? -64.26 -34.49 78.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.313 0.578 . . . . 4.5099999999999998 109.445 176.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -60.37 -51.92 67.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.452 -0.794 . . . . 0.63 110.94 177.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.471 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 31.3 mt -75.28 -19.66 59.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.384 -0.371 . . . . 1.26 111.315 -179.066 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.502 ' HG3' ' HG3' ' A' ' 85' ' ' GLU . 42.7 ttm180 -55.99 -54.89 39.35 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.445 -0.576 . . . . 3.9399999999999999 109.445 171.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 45.9 mm -57.74 -40.29 74.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.68 -0.691 . . . . 2.3599999999999999 109.956 178.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.471 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 45.4 m-70 -64.01 -28.01 69.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.562 -0.744 . . . . 0.45000000000000001 112.091 178.575 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.1 m -87.18 2.0 51.33 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.674 0.273 . . . . 1.6499999999999999 111.455 -176.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 89.16 14.34 60.63 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.419 -0.896 . . . . 1.25 112.696 177.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.502 ' HG3' ' HG3' ' A' ' 80' ' ' ARG . 7.1 pt-20 -116.95 140.6 49.27 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.16 -0.681 . . . . 3.1800000000000002 109.16 176.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm . . . . . 0 C--N 1.314 -0.949 0 CA-C-O 118.725 -0.655 . . . . 6.5599999999999996 111.414 -171.717 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.699 0 N-CA-C 111.895 -0.482 . . . . 1.95 111.895 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_exo -44.4 116.94 1.2 Allowed 'Trans proline' 0 C--O 1.235 0.367 0 C-N-CA 123.497 2.798 . . . . 1.6599999999999999 113.59 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.521 HD12 ' HA ' ' A' ' 72' ' ' SER . 91.6 mt -126.11 124.64 41.02 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.127 -0.942 . . . . 1.2 110.782 175.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.1 tppt? -82.91 140.18 32.98 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.819 -0.628 . . . . 2.54 111.526 -174.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 45.7 t -96.86 95.38 7.82 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 107.746 -1.205 . . . . 0.46000000000000002 107.746 164.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.3 ttp180 -52.17 -36.3 51.33 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 123.398 0.436 . . . . 4.4000000000000004 111.748 -177.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -71.62 -35.13 70.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.1 -0.5 . . . . 2.1800000000000002 111.355 -175.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.402 ' CB ' ' HG2' ' A' ' 67' ' ' LYS . 65.3 m -94.02 -41.48 9.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.168 0.509 . . . . 0.32000000000000001 111.364 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 103.71 6.03 44.17 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 111.205 -0.758 . . . . 0.40000000000000002 111.205 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.539 ' HE2' ' CZ ' ' A' ' 69' ' ' PHE . 11.5 ptmt -101.41 -177.31 3.4 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.101 -0.549 . . . . 1.8600000000000001 109.912 -178.286 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.405 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 35.6 tt0 -150.86 142.23 23.37 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.748 -0.66 . . . . 1.98 110.078 -168.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.627 ' CD1' HD23 ' A' ' 75' ' ' LEU . 88.1 m-85 -123.6 150.64 43.87 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-O 120.824 0.345 . . . . 0.87 111.09 -174.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.4 p -90.91 -25.26 19.9 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.164 -0.471 . . . . 2.1600000000000001 111.69 -177.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.459 HG22 ' CB ' ' A' ' 74' ' ' ASN . 0.5 OUTLIER -108.72 132.7 53.69 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.588 0.709 . . . . 1.49 110.648 -179.825 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.521 ' HA ' HD12 ' A' ' 60' ' ' LEU . 66.2 m -64.57 -43.8 92.73 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 114.763 -1.108 . . . . 1.73 111.787 -174.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.62 -33.47 86.74 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.574 -0.822 . . . . 0.38 112.326 -177.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 62.0 t30 -69.29 -40.56 77.64 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.096 -0.242 . . . . 1.8999999999999999 110.371 -179.227 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.627 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.6 tm? -76.47 -34.68 58.68 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.586 0.231 . . . . 1.1799999999999999 110.552 -179.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.566 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 8.8 mmpt? -64.85 -46.58 81.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.652 0.263 . . . . 2.5299999999999998 110.35 177.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -60.95 -41.72 96.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.694 0.759 . . . . 4.5099999999999998 109.736 174.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.48 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 61.3 t60 -58.51 -46.88 85.81 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.292 -1.322 . . . . 0.63 111.23 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.555 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 28.8 mt -83.81 -18.86 36.24 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 111.919 0.34 . . . . 1.26 111.919 -176.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -61.86 -48.18 81.67 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.803 -0.443 . . . . 3.9399999999999999 109.803 174.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 13.9 tt -70.14 -29.46 39.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.3 -0.409 . . . . 2.3599999999999999 110.481 178.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.555 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 18.3 m-70 -63.65 -29.54 70.76 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.008 0.432 . . . . 0.45000000000000001 110.29 173.172 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 47.5 m -85.81 3.2 42.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.986 -0.552 . . . . 1.6499999999999999 111.126 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 91.75 -6.11 79.71 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.758 -0.734 . . . . 1.25 112.662 177.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -83.42 110.55 18.25 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.738 0.304 . . . . 3.1800000000000002 110.413 -178.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt . . . . . 0 C--O 1.245 0.859 0 CA-C-O 118.64 -0.695 . . . . 6.5599999999999996 110.124 179.219 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.721 0 CA-C-O 119.582 -0.565 . . . . 1.95 111.772 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.531 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 27.5 Cg_endo -62.55 115.85 3.16 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 121.651 1.567 . . . . 1.6599999999999999 111.028 178.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.683 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 67.9 mt -97.57 129.76 44.67 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.268 -0.878 . . . . 1.2 111.809 -175.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 40.8 tptt -81.4 126.14 31.26 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.214 -0.903 . . . . 2.54 111.151 -172.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 28.8 t -80.39 117.29 21.01 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.721 -0.844 . . . . 0.46000000000000002 108.721 171.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -60.23 -34.97 74.42 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.661 0.615 . . . . 4.4000000000000004 112.661 -172.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -94.1 -21.59 19.02 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.64 -0.424 . . . . 2.1800000000000002 111.943 -172.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 84.3 m -99.35 -41.07 7.59 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.648 -0.421 . . . . 0.32000000000000001 111.961 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.58 2.52 58.69 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.707 -0.758 . . . . 0.40000000000000002 111.517 -177.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.663 ' HE3' ' CE1' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -90.7 -176.72 4.8 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 109.764 -0.458 . . . . 1.8600000000000001 109.764 178.429 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.683 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 4.6 pt20 -150.0 148.35 28.95 Favored 'General case' 0 C--N 1.309 -1.196 0 CA-C-N 115.898 -0.592 . . . . 1.98 111.114 -173.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.663 ' CE1' ' HE3' ' A' ' 67' ' ' LYS . 32.1 m-85 -122.44 133.29 54.62 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.315 -0.402 . . . . 0.87 111.51 -176.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.4 t -74.14 -16.28 61.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.329 0.585 . . . . 2.1600000000000001 110.32 177.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.524 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 13.1 m -109.91 128.95 55.68 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.047 -0.524 . . . . 1.49 110.136 177.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.509 ' HA ' HD12 ' A' ' 60' ' ' LEU . 42.5 t -69.16 -40.76 77.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.513 -0.767 . . . . 1.73 110.901 -176.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.36 -38.49 95.03 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.656 -0.783 . . . . 0.38 111.983 178.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.524 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 39.9 m-20 -61.05 -43.08 99.43 Favored 'General case' 0 C--O 1.221 -0.435 0 C-N-CA 121.434 -0.106 . . . . 1.8999999999999999 110.927 178.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.511 HD22 ' CD1' ' A' ' 69' ' ' PHE . 1.6 tm? -69.79 -37.37 76.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.816 0.341 . . . . 1.1799999999999999 110.267 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.528 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -66.96 -45.5 77.57 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.841 -0.344 . . . . 2.5299999999999998 110.11 179.734 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.56 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 4.9 tmt_? -64.99 -33.91 77.18 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.441 0.639 . . . . 4.5099999999999998 109.817 175.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -63.92 -43.77 94.92 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.307 -0.861 . . . . 0.63 110.616 177.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.585 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 44.1 mt -80.05 -18.59 49.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.942 0.401 . . . . 1.26 110.635 178.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.56 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 28.7 tpt180 -56.31 -47.61 78.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.021 -0.536 . . . . 3.9399999999999999 109.936 172.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 tp -74.7 -27.35 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 120.647 -0.421 . . . . 2.3599999999999999 110.606 178.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.585 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 28.5 m-70 -65.63 -26.03 67.64 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.087 0.47 . . . . 0.45000000000000001 110.955 174.153 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 56.7 m -74.78 -22.08 58.96 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.981 -0.554 . . . . 1.6499999999999999 110.523 176.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.91 -3.04 72.03 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 121.021 -0.609 . . . . 1.25 112.802 177.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -68.15 119.38 12.64 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 121.096 0.474 . . . . 3.1800000000000002 110.87 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.246 0.915 0 CA-C-N 115.349 -0.841 . . . . 6.5599999999999996 109.751 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.886 0 CA-C-O 119.785 -0.453 . . . . 1.95 112.098 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.468 ' CB ' ' HB3' ' A' ' 68' ' ' GLN . 70.6 Cg_exo -52.61 115.99 2.58 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.451 2.101 . . . . 1.6599999999999999 112.244 -179.242 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.674 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 99.5 mt -86.1 128.96 34.97 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.058 -0.974 . . . . 1.2 110.62 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -81.8 129.75 34.84 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.246 -0.434 . . . . 2.54 111.627 -172.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 19.5 t -82.5 128.77 34.6 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 108.688 -0.856 . . . . 0.46000000000000002 108.688 169.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.523 ' HA ' ' NE ' ' A' ' 63' ' ' ARG . 1.2 mmp_? -71.14 -38.88 72.23 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.109 -0.496 . . . . 4.4000000000000004 111.973 -172.217 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -90.46 -12.27 37.86 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.164 0.431 . . . . 2.1800000000000002 112.164 -174.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.425 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 99.1 m -109.67 -41.72 4.48 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.652 -0.419 . . . . 0.32000000000000001 111.703 178.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 96.19 1.3 61.12 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.513 -0.851 . . . . 0.40000000000000002 111.698 -177.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.489 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 17.9 ptmt -88.28 -177.72 5.74 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 122.816 0.446 . . . . 1.8600000000000001 110.126 179.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.674 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 57.3 mt-30 -145.14 144.11 30.72 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.733 -0.667 . . . . 1.98 111.405 -170.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.534 ' CD1' HD22 ' A' ' 75' ' ' LEU . 50.4 m-85 -123.1 135.92 54.58 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.162 -0.472 . . . . 0.87 111.454 -178.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.6 p -83.67 -4.52 58.67 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.256 -0.429 . . . . 2.1600000000000001 111.448 -178.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.48 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 28.5 m -123.76 129.64 51.38 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.981 -0.554 . . . . 1.49 109.924 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.1 t -61.11 -52.89 62.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.416 -0.811 . . . . 1.73 111.579 -175.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.95 -29.22 71.89 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.883 -0.675 . . . . 0.38 112.424 179.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.48 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 0.9 OUTLIER -66.39 -37.74 85.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.565 0.221 . . . . 1.8999999999999999 110.672 178.72 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.534 HD22 ' CD1' ' A' ' 69' ' ' PHE . 1.8 tm? -81.06 -32.01 34.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.373 -0.376 . . . . 1.1799999999999999 110.299 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.553 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -67.39 -47.0 71.61 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.754 0.279 . . . . 2.5299999999999998 111.754 179.148 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -31.74 73.09 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.9 0.857 . . . . 4.5099999999999998 109.092 176.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 72.7 t60 -65.29 -52.09 56.49 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.229 -1.35 . . . . 0.63 110.45 179.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.515 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 19.3 mt -76.28 -18.65 58.88 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.083 -0.508 . . . . 1.26 111.295 -179.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -55.44 -47.06 76.61 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.194 -0.669 . . . . 3.9399999999999999 109.194 170.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 47.7 mm -61.8 -41.57 91.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.415 -0.812 . . . . 2.3599999999999999 110.314 175.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.515 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 62.7 m-70 -70.12 -23.81 63.08 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.8 -0.637 . . . . 0.45000000000000001 112.542 -177.541 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 22.2 m -85.52 -11.51 53.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.908 0.385 . . . . 1.6499999999999999 111.062 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 87.9 22.85 40.67 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.693 -0.765 . . . . 1.25 111.9 -178.049 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -90.78 125.61 35.76 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.285 -0.635 . . . . 3.1800000000000002 109.285 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 51.8 tttp . . . . . 0 C--O 1.248 1.015 0 CA-C-N 115.744 -0.662 . . . . 6.5599999999999996 110.621 -176.299 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.754 0 N-CA-C 112.245 -0.342 . . . . 1.95 112.245 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.914 ' HB2' HE21 ' A' ' 68' ' ' GLN . 17.4 Cg_exo -69.01 117.59 5.13 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 122.13 1.887 . . . . 1.6599999999999999 111.13 174.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.684 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 83.6 mt -83.55 131.67 34.97 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.027 -0.988 . . . . 1.2 111.001 -176.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.551 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 48.5 tptt -81.82 122.24 27.46 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.839 -0.619 . . . . 2.54 111.888 -171.062 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 42.3 t -91.73 96.9 10.68 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 107.406 -1.331 . . . . 0.46000000000000002 107.406 169.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 63' ' ' ARG . 59.7 mtt85 -57.49 -30.94 65.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.07 0.462 . . . . 4.4000000000000004 110.973 -177.361 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -69.18 -37.29 78.07 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.7 -0.682 . . . . 2.1800000000000002 110.987 -176.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . 0.443 ' HB3' ' HD3' ' A' ' 67' ' ' LYS . 67.7 m -94.57 -42.13 8.97 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 121.639 0.733 . . . . 0.32000000000000001 111.2 177.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.63 3.01 43.54 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-N 114.891 -1.05 . . . . 0.40000000000000002 111.32 -177.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.443 ' HD3' ' HB3' ' A' ' 65' ' ' CYS . 18.1 pttt -108.36 -178.24 3.55 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-O 120.886 0.374 . . . . 1.8600000000000001 110.07 -176.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.914 HE21 ' HB2' ' A' ' 59' ' ' PRO . 29.0 mt-30 -141.35 147.28 37.83 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.718 -0.674 . . . . 1.98 111.356 -168.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.46 ' CD1' HD22 ' A' ' 75' ' ' LEU . 54.1 m-85 -126.81 125.0 40.97 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.403 -0.362 . . . . 0.87 111.256 -176.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.7 p -68.42 -22.21 64.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.369 -0.378 . . . . 2.1600000000000001 111.877 -176.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.01 129.28 48.26 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.227 0.537 . . . . 1.49 110.644 179.223 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.545 ' O ' ' HG2' ' A' ' 76' ' ' LYS . 40.7 t -65.59 -43.77 88.68 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.283 -0.871 . . . . 1.73 111.039 -176.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.441 ' O ' ' HG3' ' A' ' 77' ' ' ARG . . . -68.72 -33.35 75.69 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.901 -0.666 . . . . 0.38 111.983 179.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -57.68 -45.14 86.0 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.347 -0.612 . . . . 1.8999999999999999 109.347 176.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.482 HD12 ' HG ' ' A' ' 79' ' ' LEU . 1.2 tm? -71.04 -31.25 67.66 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.702 -0.681 . . . . 1.1799999999999999 110.379 179.25 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.545 ' HG2' ' O ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -65.04 -50.75 65.01 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.886 0.374 . . . . 2.5299999999999998 109.999 176.851 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 73' ' ' GLY . 81.3 mtt180 -59.28 -39.19 82.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.673 0.749 . . . . 4.5099999999999998 109.573 174.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -63.18 -36.92 85.22 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.625 -1.17 . . . . 0.63 111.45 -177.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.523 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 37.1 mt -85.74 -23.85 27.16 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 122.212 -0.305 . . . . 1.26 111.242 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.446 ' HA ' ' O ' ' A' ' 85' ' ' GLU . 46.3 ttp180 -59.11 -38.64 80.04 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.924 -0.398 . . . . 3.9399999999999999 109.924 173.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 17.2 tt -82.22 -26.15 9.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 C-N-CA 120.83 -0.348 . . . . 2.3599999999999999 110.564 178.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.523 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 13.3 m-70 -66.29 -47.19 74.42 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.801 0.334 . . . . 0.45000000000000001 110.842 175.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.4 m -86.73 -13.16 46.13 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.295 -0.411 . . . . 1.6499999999999999 110.962 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 88.15 -9.5 74.65 Favored Glycine 0 N--CA 1.453 -0.195 0 C-N-CA 121.007 -0.616 . . . . 1.25 111.738 -178.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.446 ' O ' ' HA ' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -150.76 167.35 27.69 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 122.659 0.384 . . . . 3.1800000000000002 110.421 -179.857 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 84.0 tttt . . . . . 0 C--O 1.243 0.736 0 CA-C-O 118.481 -0.771 . . . . 6.5599999999999996 109.284 172.871 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.8 0 CA-C-O 119.644 -0.531 . . . . 1.95 112.065 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.795 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 81.7 Cg_exo -47.62 115.91 1.62 Allowed 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 122.45 2.1 . . . . 1.6599999999999999 112.152 176.277 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.461 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 62.1 mt -130.71 123.94 30.41 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 115.812 -0.631 . . . . 1.2 111.397 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.9 tptm -82.04 129.59 34.84 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.3 -0.864 . . . . 2.54 110.572 -174.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 47.3 t -86.39 97.07 10.24 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 108.119 -1.067 . . . . 0.46000000000000002 108.119 172.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 mtp180 -59.47 -23.77 63.01 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.721 0.296 . . . . 4.4000000000000004 111.56 -175.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -84.56 -20.97 30.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.531 -0.304 . . . . 2.1800000000000002 111.425 -178.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 55.4 m -107.2 -41.97 4.98 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.923 0.392 . . . . 0.32000000000000001 111.769 178.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.72 -3.11 42.04 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.742 -0.742 . . . . 0.40000000000000002 111.722 -179.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.42 -176.85 3.19 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 109.54 -0.541 . . . . 1.8600000000000001 109.54 178.454 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -139.81 149.89 44.05 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 116.126 -0.488 . . . . 1.98 110.492 -162.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.795 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 55.7 m-85 -117.27 179.76 3.95 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 116.345 -0.389 . . . . 0.87 110.476 -179.299 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 25.4 p -129.54 17.83 5.84 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.129 0.49 . . . . 2.1600000000000001 111.051 -179.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.621 ' HB ' ' CB ' ' A' ' 74' ' ' ASN . 22.7 m -141.97 129.46 21.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.92 -0.582 . . . . 1.49 109.767 -179.019 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.461 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 11.9 m -66.2 -42.08 89.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.644 -0.707 . . . . 1.73 111.296 -175.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.61 -35.42 59.21 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.449 -0.882 . . . . 0.38 111.953 177.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.621 ' CB ' ' HB ' ' A' ' 71' ' ' THR . 43.6 t-20 -58.59 -50.68 72.94 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.706 0.289 . . . . 1.8999999999999999 110.319 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.478 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.2 tm? -75.41 -32.49 60.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.112 -0.495 . . . . 1.1799999999999999 111.184 -175.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.581 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -69.7 -45.11 68.99 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.84 -0.744 . . . . 2.5299999999999998 110.186 -178.575 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 9.7 tpp180 -62.7 -33.51 75.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.758 0.79 . . . . 4.5099999999999998 109.414 174.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.423 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 65.8 t60 -65.0 -39.0 92.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.421 -1.263 . . . . 0.63 110.706 177.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.486 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 54.3 mt -81.83 -23.63 36.32 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.534 -0.303 . . . . 1.26 111.808 -179.446 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.815 ' HA ' ' O ' ' A' ' 85' ' ' GLU . 71.6 ttt180 -62.28 -40.09 95.1 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.678 -0.489 . . . . 3.9399999999999999 109.678 173.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.5 tt -83.25 -10.82 11.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-O 121.07 0.462 . . . . 2.3599999999999999 110.86 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.486 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 13.6 m-70 -86.35 -47.3 9.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.263 -0.426 . . . . 0.45000000000000001 110.501 173.607 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.0 m -85.68 -25.75 26.35 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.034 -0.53 . . . . 1.6499999999999999 111.056 -174.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 95.02 -0.82 64.59 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 110.999 -0.841 . . . . 1.25 110.999 -175.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.815 ' O ' ' HA ' ' A' ' 80' ' ' ARG . 4.5 pt-20 -150.42 -179.85 7.56 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.416 -0.392 . . . . 3.1800000000000002 111.341 -177.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt . . . . . 0 C--O 1.246 0.908 0 O-C-N 124.361 1.038 . . . . 6.5599999999999996 112.292 -177.461 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.666 0 CA-C-O 119.651 -0.527 . . . . 1.95 112.107 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -55.78 116.45 3.17 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.664 2.242 . . . . 1.6599999999999999 112.491 -178.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 88.7 mt -121.0 103.64 9.2 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.361 -1.29 . . . . 1.2 110.309 177.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.929 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 24.4 mtmm -78.99 130.19 35.27 Favored 'General case' 0 CA--C 1.511 -0.529 0 C-N-CA 120.389 -0.524 . . . . 2.54 110.806 -175.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 35.7 t -68.35 110.29 4.03 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 108.593 -0.891 . . . . 0.46000000000000002 108.593 170.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 ttp180 -57.93 -30.43 65.94 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 123.171 0.294 . . . . 4.4000000000000004 111.741 -175.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -85.29 -26.78 26.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.57 -0.286 . . . . 2.1800000000000002 111.663 -174.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 93.6 m -103.15 -40.24 6.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.968 0.413 . . . . 0.32000000000000001 111.278 -178.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.75 -1.11 52.32 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 121.141 -0.552 . . . . 0.40000000000000002 112.043 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.95 129.86 55.44 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 122.129 0.966 . . . . 1.8600000000000001 110.739 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.929 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 3.8 pt20 -81.33 161.9 23.65 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 113.384 -1.735 . . . . 1.98 112.917 -176.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.576 ' CD1' HD21 ' A' ' 75' ' ' LEU . 34.1 m-85 -130.92 131.8 44.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.702 -1.136 . . . . 0.87 109.446 176.128 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.7 t -84.05 -4.53 58.82 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.005 0.431 . . . . 2.1600000000000001 111.147 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.2 m -115.52 129.27 56.48 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.264 0.554 . . . . 1.49 110.201 179.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.8 p -65.65 -50.06 66.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.177 -0.919 . . . . 1.73 111.854 -175.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.65 -29.52 67.17 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.839 -0.696 . . . . 0.38 112.575 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.437 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 6.0 m120 -68.59 -55.02 12.98 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.327 0.108 . . . . 1.8999999999999999 110.766 176.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.576 HD21 ' CD1' ' A' ' 69' ' ' PHE . 1.1 tm? -69.82 -32.23 70.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.624 -0.262 . . . . 1.1799999999999999 111.123 -175.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.404 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 20.8 mmmt -67.68 -51.62 47.49 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.733 -0.387 . . . . 2.5299999999999998 111.328 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -64.68 -29.13 70.12 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.592 0.71 . . . . 4.5099999999999998 109.565 176.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.437 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 53.3 t60 -64.44 -48.86 73.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.972 -1.013 . . . . 0.63 110.587 177.005 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.497 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 33.1 mt -79.49 -19.55 49.44 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.723 0.296 . . . . 1.26 111.04 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.504 ' HG3' ' HB3' ' A' ' 85' ' ' GLU . 60.8 ttt180 -58.54 -48.68 80.06 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.062 -0.517 . . . . 3.9399999999999999 110.385 175.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.0 tt -72.3 -30.14 34.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.459 -0.337 . . . . 2.3599999999999999 110.326 178.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.497 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 33.4 m-70 -64.21 -41.24 97.13 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.104 0.478 . . . . 0.45000000000000001 110.791 174.747 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 10.8 t -74.38 -12.05 60.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.965 -0.561 . . . . 1.6499999999999999 110.589 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 86.46 23.23 44.3 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 121.021 -0.609 . . . . 1.25 112.661 177.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.504 ' HB3' ' HG3' ' A' ' 80' ' ' ARG . 7.1 tp10 -80.52 90.06 5.67 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 121.333 0.587 . . . . 3.1800000000000002 109.942 179.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 57.9 tptt . . . . . 0 C--O 1.248 1.021 0 CA-C-N 115.35 -0.841 . . . . 6.5599999999999996 109.963 -179.614 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 95.5 mt . . . . . 0 N--CA 1.451 -0.394 0 CA-C-O 121.179 0.514 . . . . 0.52000000000000002 110.821 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.406 ' HD3' ' O ' ' A' ' 67' ' ' LYS . 15.2 tppt? -81.77 128.75 34.32 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.489 -0.778 . . . . 1.99 110.865 -174.268 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 43.2 t -91.47 101.91 14.58 Favored 'General case' 0 N--CA 1.439 -0.989 0 N-CA-C 108.617 -0.883 . . . . 0.46000000000000002 108.617 171.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -55.75 -31.92 62.97 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.602 0.564 . . . . 3.8599999999999999 111.131 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -73.14 -45.53 56.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.004 -0.544 . . . . 2.1800000000000002 111.479 -177.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.565 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 65.9 m -86.63 -41.08 14.53 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.381 0.61 . . . . 0.32000000000000001 110.712 -176.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.68 -0.56 52.61 Favored Glycine 0 N--CA 1.443 -0.891 0 N-CA-C 110.657 -0.977 . . . . 0.40000000000000002 110.657 -176.112 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.565 ' HG2' ' HB2' ' A' ' 65' ' ' CYS . 18.4 ptmt -92.17 -177.66 4.74 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.067 -0.567 . . . . 1.28 109.894 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.481 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 29.6 tt0 -156.72 137.1 12.97 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.603 -0.726 . . . . 1.77 110.463 -171.318 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.543 ' CD1' HD23 ' A' ' 75' ' ' LEU . 62.3 m-85 -109.96 -174.69 2.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.226 -0.443 . . . . 0.87 110.132 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.4 t -140.86 17.41 2.31 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.757 0.789 . . . . 1.77 108.948 170.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 16.9 m -131.89 128.69 39.11 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.142 -0.936 . . . . 0.90000000000000002 109.555 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.9 t -65.03 -52.37 56.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.982 -1.008 . . . . 1.4199999999999999 112.229 -172.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.57 -40.59 98.05 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.979 -0.629 . . . . 0.32000000000000001 112.899 -176.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -63.65 -47.19 82.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.618 0.209 . . . . 1.8100000000000001 111.455 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.543 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.8 tm? -72.47 -35.72 68.28 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.263 -0.273 . . . . 0.38 110.263 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.1 mmmt -62.6 -52.72 62.26 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.956 -0.298 . . . . 1.9299999999999999 110.958 177.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -61.43 -32.36 72.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.22 0.533 . . . . 3.9199999999999999 110.215 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -65.57 -45.64 82.55 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.394 -0.821 . . . . 0.48999999999999999 110.764 178.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.548 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 23.4 mt -79.77 -19.16 49.33 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.923 0.392 . . . . 0.51000000000000001 110.644 -179.266 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -58.8 -47.55 84.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.919 -0.582 . . . . 3.4100000000000001 109.556 173.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 65.4 mt -64.1 -41.28 91.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.511 -0.768 . . . . 1.8300000000000001 110.132 176.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.548 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 36.3 m-70 -60.31 -40.35 90.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.641 -0.708 . . . . 0.45000000000000001 111.741 178.839 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 28.4 m . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.338 -0.392 . . . . 1.21 111.572 -176.507 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.524 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 79.6 mt . . . . . 0 CA--C 1.514 -0.417 0 CA-C-O 121.016 0.436 . . . . 0.52000000000000002 110.604 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.409 ' HD2' ' O ' ' A' ' 67' ' ' LYS . 21.5 tptm -82.11 128.85 34.54 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.552 -0.749 . . . . 1.99 111.279 -171.061 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 54.1 t -89.76 106.5 18.51 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 107.715 -1.217 . . . . 0.46000000000000002 107.715 171.326 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.4 mtm180 -64.13 -35.88 82.2 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.373 0.606 . . . . 3.8599999999999999 110.013 -175.11 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -68.02 -36.01 79.25 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.931 -1.031 . . . . 2.1800000000000002 111.381 -177.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 90.4 m -97.44 -42.07 7.9 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.088 0.471 . . . . 0.32000000000000001 111.834 -178.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.98 4.52 48.05 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 121.021 -0.609 . . . . 0.40000000000000002 111.622 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.409 ' O ' ' HD2' ' A' ' 61' ' ' LYS . 17.0 ptmt -103.92 -176.28 3.04 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 123.273 0.629 . . . . 1.28 109.354 179.003 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.461 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 17.2 pt20 -148.4 151.86 35.99 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 120.799 0.333 . . . . 1.77 111.247 -174.008 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.54 ' CD1' HD23 ' A' ' 75' ' ' LEU . 58.8 m-85 -117.58 176.18 5.29 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 116.166 -0.47 . . . . 0.87 110.412 -176.661 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 76.3 p -112.81 -21.23 11.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.889 0.376 . . . . 1.77 111.535 -177.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.6 p -112.22 134.16 53.93 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.409 0.623 . . . . 0.90000000000000002 111.389 -175.434 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.524 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 23.3 m -64.01 -46.39 84.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.946 -1.025 . . . . 1.4199999999999999 111.891 -175.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.9 -35.2 78.76 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.43 -0.89 . . . . 0.32000000000000001 112.341 -177.116 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -68.48 -42.68 78.33 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.629 0.252 . . . . 1.8100000000000001 110.693 -176.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.54 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.4 tm? -72.51 -41.29 66.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.516 -0.311 . . . . 0.38 110.825 -179.27 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.51 -41.84 79.4 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.269 -0.572 . . . . 1.9299999999999999 110.766 -177.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -62.15 -36.54 82.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.222 0.534 . . . . 3.9199999999999999 109.788 172.598 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' HIS . . . . . 0.416 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 82.0 t60 -63.26 -47.84 80.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.376 -0.829 . . . . 0.48999999999999999 111.034 177.329 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.484 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 35.0 mt -73.29 -19.6 61.01 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 121.197 -0.201 . . . . 0.51000000000000001 111.328 -177.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -64.91 -38.71 91.86 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.188 -0.671 . . . . 3.4100000000000001 109.188 171.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 54.8 mt -66.08 -37.14 79.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.854 -0.612 . . . . 1.8300000000000001 109.64 176.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.484 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 21.6 m-70 -67.51 -33.76 75.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.449 -0.796 . . . . 0.45000000000000001 111.658 178.254 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 29.2 t . . . . . 0 C--N 1.322 -0.606 0 CA-C-O 120.873 0.368 . . . . 1.21 111.554 -177.56 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 72' ' ' SER . 59.7 mt . . . . . 0 CA--C 1.517 -0.319 0 CA-C-O 121.026 0.441 . . . . 0.52000000000000002 110.816 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -82.14 131.38 35.24 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.429 -0.805 . . . . 1.99 111.758 -170.216 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 48.6 t -97.38 118.2 33.32 Favored 'General case' 0 N--CA 1.438 -1.057 0 N-CA-C 107.795 -1.187 . . . . 0.46000000000000002 107.795 169.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.48 ' HD3' ' H ' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -73.35 -40.45 64.41 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.199 0.523 . . . . 3.8599999999999999 110.141 -174.335 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -66.43 -36.59 83.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.133 -0.939 . . . . 2.1800000000000002 110.798 -176.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 94.2 m -92.6 -41.18 10.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.101 -0.499 . . . . 0.32000000000000001 110.987 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.56 9.89 54.22 Favored Glycine 0 N--CA 1.451 -0.315 0 N-CA-C 111.409 -0.676 . . . . 0.40000000000000002 111.409 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -110.63 -176.25 2.93 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 123.574 0.75 . . . . 1.28 109.532 -178.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.49 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 9.5 pt20 -138.9 156.23 47.44 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 116.012 -0.54 . . . . 1.77 110.887 -177.175 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.646 ' CD1' HD23 ' A' ' 75' ' ' LEU . 40.1 m-85 -122.04 128.62 51.61 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.165 -0.47 . . . . 0.87 111.106 -178.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -69.23 -14.93 63.24 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.977 -0.556 . . . . 1.77 111.689 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 24.4 m -112.8 129.05 56.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.037 0.446 . . . . 0.90000000000000002 110.274 -178.219 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.518 ' HA ' HD12 ' A' ' 60' ' ' LEU . 7.8 m -69.31 -53.63 18.72 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.401 -0.818 . . . . 1.4199999999999999 112.333 -172.094 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.57 -27.87 73.54 Favored Glycine 0 CA--C 1.508 -0.366 0 C-N-CA 120.697 -0.763 . . . . 0.32000000000000001 112.0 -178.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -66.47 -44.53 82.46 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.855 -0.424 . . . . 1.8100000000000001 109.855 178.068 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.646 HD23 ' CD1' ' A' ' 69' ' ' PHE . 2.5 tm? -67.7 -39.97 84.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.484 . . . . 0.38 110.067 178.33 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.564 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 3.5 mmpt? -61.9 -43.3 99.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.873 0.368 . . . . 1.9299999999999999 110.829 177.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.461 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 41.6 ttm180 -66.57 -38.82 87.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.164 -0.471 . . . . 3.9199999999999999 110.58 175.157 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -64.02 -47.27 80.92 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.879 -0.601 . . . . 0.48999999999999999 111.433 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.579 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 18.5 mt -75.09 -19.77 59.8 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 121.056 -0.257 . . . . 0.51000000000000001 110.967 -178.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.461 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 0.3 OUTLIER -57.48 -46.13 84.04 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.938 -0.764 . . . . 3.4100000000000001 108.938 170.556 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 52.3 mt -68.18 -38.09 79.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.351 -0.84 . . . . 1.8300000000000001 110.545 178.107 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.579 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 16.5 m-70 -61.84 -31.22 71.45 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.282 -0.417 . . . . 0.45000000000000001 111.311 177.354 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.1 m . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 116.083 -0.508 . . . . 1.21 111.157 -178.858 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.63 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 75.0 mt . . . . . 0 CA--C 1.514 -0.423 0 CA-C-O 120.929 0.395 . . . . 0.52000000000000002 111.568 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 36.4 tptt -81.59 117.53 22.04 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.727 -0.669 . . . . 1.99 110.929 -172.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 40.4 t -78.57 112.67 15.88 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.086 -0.709 . . . . 0.46000000000000002 109.086 174.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 63.8 ttt180 -59.95 -36.99 78.25 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.054 -0.521 . . . . 3.8599999999999999 111.43 -177.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.3 mp0 -76.52 -36.01 57.97 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.029 -0.532 . . . . 2.1800000000000002 111.79 -176.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.479 ' HB3' ' HD3' ' A' ' 67' ' ' LYS . 80.1 m -93.34 -41.34 9.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.099 0.476 . . . . 0.32000000000000001 111.584 -177.512 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.8 -0.75 59.43 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.539 -0.755 . . . . 0.40000000000000002 111.617 -176.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.479 ' HD3' ' HB3' ' A' ' 65' ' ' CYS . 12.2 pttt -103.72 -177.78 3.47 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 108.762 -0.829 . . . . 1.28 108.762 178.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.63 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 13.4 pt20 -145.67 156.5 43.68 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 116.484 -0.325 . . . . 1.77 111.327 -170.76 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.602 ' CD2' HD23 ' A' ' 75' ' ' LEU . 43.6 m-85 -131.03 137.82 49.35 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-N 116.03 -0.532 . . . . 0.87 111.416 -170.289 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.9 m -72.6 -32.69 66.17 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.48 -0.782 . . . . 1.77 112.011 -173.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.52 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 24.9 m -100.97 128.84 46.82 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.392 0.615 . . . . 0.90000000000000002 110.379 -179.554 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.565 ' HA ' HD12 ' A' ' 60' ' ' LEU . 22.9 t -64.95 -44.71 88.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.211 -0.904 . . . . 1.4199999999999999 110.964 -176.575 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.53 -31.11 79.12 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.842 -0.694 . . . . 0.32000000000000001 112.088 177.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.52 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 5.2 t30 -67.75 -45.58 74.56 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.78 -0.452 . . . . 1.8100000000000001 109.78 178.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.602 HD23 ' CD2' ' A' ' 69' ' ' PHE . 1.5 tm? -68.63 -35.35 77.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.003 -0.544 . . . . 0.38 109.698 178.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.578 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -63.15 -47.83 81.06 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.891 -0.411 . . . . 1.9299999999999999 109.891 177.861 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.493 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 7.8 tpt180 -63.69 -38.7 92.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.29 0.567 . . . . 3.9199999999999999 110.355 175.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -61.48 -41.88 97.94 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.475 -0.784 . . . . 0.48999999999999999 110.502 177.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 31.6 mt -75.85 -19.56 58.8 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.27 -0.423 . . . . 0.51000000000000001 111.349 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.493 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 27.3 ttt85 -61.05 -44.07 97.93 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.587 -0.523 . . . . 3.4100000000000001 109.587 173.391 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 48.2 mm -61.3 -46.19 97.11 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.527 -0.761 . . . . 1.8300000000000001 110.086 175.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -58.26 -43.03 87.69 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.671 -0.695 . . . . 0.45000000000000001 111.436 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 24.2 m . . . . . 0 C--N 1.325 -0.482 0 CA-C-N 116.144 -0.48 . . . . 1.21 111.601 -177.29 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.49 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 97.6 mt . . . . . 0 C--O 1.223 -0.299 0 CA-C-O 121.066 0.46 . . . . 0.52000000000000002 111.35 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.6 tptp -81.47 132.68 35.33 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.835 -0.621 . . . . 1.99 111.112 -172.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 53.2 t -93.91 116.64 29.11 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.062 -1.088 . . . . 0.46000000000000002 108.062 171.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 46.9 mtp180 -71.9 -37.33 70.13 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.992 0.425 . . . . 3.8599999999999999 111.143 -176.244 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.456 ' OE2' ' HB3' ' A' ' 82' ' ' HIS . 4.5 mp0 -65.6 -35.34 80.53 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.887 -0.597 . . . . 2.1800000000000002 111.734 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.42 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 85.8 m -98.42 -40.5 8.25 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.948 0.404 . . . . 0.32000000000000001 111.512 -178.185 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 103.7 -6.52 48.71 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 111.442 -0.663 . . . . 0.40000000000000002 111.442 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.601 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 17.7 ptmt -90.37 -176.35 4.77 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.058 -0.571 . . . . 1.28 110.438 -177.109 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -143.18 141.43 31.14 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.369 -0.832 . . . . 1.77 109.905 -172.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.601 ' CE1' ' HE2' ' A' ' 67' ' ' LYS . 6.6 m-85 -108.53 174.12 6.01 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 110.214 -0.291 . . . . 0.87 110.214 -177.007 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 64.8 p -119.65 -31.74 4.48 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.976 0.417 . . . . 1.77 110.812 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.1 p -97.71 129.34 44.76 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.507 0.67 . . . . 0.90000000000000002 110.815 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.49 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 20.2 p -64.87 -42.84 94.51 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.143 -0.935 . . . . 1.4199999999999999 112.023 -173.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.08 -32.55 76.94 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.551 -0.833 . . . . 0.32000000000000001 112.003 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -67.6 -43.65 80.01 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 121.315 -0.154 . . . . 1.8100000000000001 111.005 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.526 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.5 tm? -74.28 -35.17 63.74 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 121.04 -0.264 . . . . 0.38 110.429 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.558 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -60.5 -55.05 38.11 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.473 0.178 . . . . 1.9299999999999999 111.309 178.384 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -62.57 -30.7 71.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.289 0.566 . . . . 3.9199999999999999 110.045 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -69.21 -43.1 74.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.331 -0.85 . . . . 0.48999999999999999 111.751 -178.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.508 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 18.0 mt -79.15 -23.87 43.69 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.179 -0.609 . . . . 0.51000000000000001 110.801 -178.326 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -58.27 -47.66 82.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.091 -0.504 . . . . 3.4100000000000001 110.324 173.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.7 tt -73.36 -32.47 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-O 120.688 0.28 . . . . 1.8300000000000001 110.682 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.508 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 6.7 m-70 -58.17 -49.86 75.55 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.061 0.458 . . . . 0.45000000000000001 110.646 174.693 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 24.1 m . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 115.854 -0.612 . . . . 1.21 111.58 -178.545 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.584 HD12 ' HA ' ' A' ' 72' ' ' SER . 36.4 mt . . . . . 0 CA--C 1.511 -0.522 0 CA-C-O 120.948 0.404 . . . . 0.52000000000000002 110.961 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.678 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 71.5 tttt -81.2 120.69 25.2 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.132 -0.486 . . . . 1.99 110.913 -175.267 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 16.9 t -69.18 127.98 35.02 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 109.171 -0.677 . . . . 0.46000000000000002 109.171 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 36.2 ttt-85 -66.52 -47.34 73.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.956 -0.566 . . . . 3.8599999999999999 111.345 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.2 mp0 -72.37 -39.53 67.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.16 -0.473 . . . . 2.1800000000000002 111.77 -174.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.459 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 89.3 m -88.82 -40.52 13.1 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.2 0.524 . . . . 0.32000000000000001 110.651 -177.259 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 93.77 8.48 60.65 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 115.213 -0.903 . . . . 0.40000000000000002 111.381 -174.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.459 ' HG2' ' HB2' ' A' ' 65' ' ' CYS . 0.0 OUTLIER -109.41 129.76 55.53 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 122.04 0.924 . . . . 1.28 110.829 -175.727 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.678 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 58.8 mt-30 -86.62 147.78 25.76 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 113.826 -1.534 . . . . 1.77 112.218 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.569 ' CD1' HD23 ' A' ' 75' ' ' LEU . 24.8 m-85 -118.31 127.35 53.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.398 -0.819 . . . . 0.87 110.077 177.537 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.7 t -74.22 -18.78 60.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.812 0.339 . . . . 1.77 110.656 -178.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.8 m -101.74 127.94 48.28 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.538 -0.541 . . . . 0.90000000000000002 109.538 176.182 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.584 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.1 m -70.52 -44.12 68.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.73 -0.668 . . . . 1.4199999999999999 111.756 -172.335 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.519 ' O ' ' HG2' ' A' ' 77' ' ' ARG . . . -65.26 -36.73 93.15 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.567 -0.825 . . . . 0.32000000000000001 112.234 178.747 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -57.7 -48.8 78.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.706 0.289 . . . . 1.8100000000000001 110.407 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.569 HD23 ' CD1' ' A' ' 69' ' ' PHE . 2.2 tm? -67.31 -35.27 79.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.085 -0.507 . . . . 0.38 110.369 -179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.604 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -65.89 -45.42 82.1 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 110.234 -0.284 . . . . 1.9299999999999999 110.234 179.787 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.672 ' O ' ' HG2' ' A' ' 80' ' ' ARG . 23.7 mmt180 -62.35 -41.83 98.9 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.493 0.663 . . . . 3.9199999999999999 109.515 173.731 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -58.27 -44.82 88.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.026 -0.988 . . . . 0.48999999999999999 111.463 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.464 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 18.7 mt -79.61 -25.91 41.35 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.417 0.525 . . . . 0.51000000000000001 112.417 -176.539 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.672 ' HG2' ' O ' ' A' ' 77' ' ' ARG . 12.5 ptm180 -70.24 -18.7 63.15 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.204 -0.598 . . . . 3.4100000000000001 109.461 177.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.541 HG12 ' O ' ' A' ' 77' ' ' ARG . 41.0 mm -81.12 -32.45 12.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.124 -0.695 . . . . 1.8300000000000001 109.124 171.736 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.464 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 20.6 m-70 -68.83 -41.2 78.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.077 -0.965 . . . . 0.45000000000000001 111.33 178.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.3 p . . . . . 0 C--N 1.324 -0.542 0 CA-C-O 121.068 0.461 . . . . 1.21 111.091 178.497 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.519 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 83.6 mt . . . . . 0 N--CA 1.45 -0.45 0 CA-C-O 121.205 0.526 . . . . 0.52000000000000002 110.557 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -82.26 127.88 33.63 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.19 -0.914 . . . . 1.99 111.481 -172.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 52.5 t -88.48 106.9 18.58 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 108.578 -0.897 . . . . 0.46000000000000002 108.578 170.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -63.01 -30.11 71.35 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.133 -0.485 . . . . 3.8599999999999999 111.648 -174.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -85.32 -26.28 26.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.301 -0.409 . . . . 2.1800000000000002 111.461 -174.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 79.8 m -99.68 -42.58 6.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.04 0.447 . . . . 0.32000000000000001 111.666 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.36 -10.04 42.52 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.269 -0.732 . . . . 0.40000000000000002 111.269 -176.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.512 ' HE3' ' CZ ' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -81.22 -178.11 6.77 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 121.088 0.47 . . . . 1.28 110.099 179.834 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.504 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 27.7 tt0 -160.34 141.22 11.99 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 115.311 -0.859 . . . . 1.77 110.378 -172.016 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.512 ' CZ ' ' HE3' ' A' ' 67' ' ' LYS . 96.1 m-85 -118.41 172.65 7.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.853 0.358 . . . . 0.87 111.425 -175.011 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.2 t -119.46 -10.53 9.65 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.549 0.69 . . . . 1.77 109.243 172.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 22.8 m -99.13 128.84 45.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.734 -0.667 . . . . 0.90000000000000002 110.031 177.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.519 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 14.0 m -70.61 -51.13 30.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.611 -0.722 . . . . 1.4199999999999999 111.419 -174.266 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.414 ' O ' ' HG3' ' A' ' 77' ' ' ARG . . . -62.33 -33.95 87.74 Favored Glycine 0 CA--C 1.51 -0.276 0 C-N-CA 120.867 -0.682 . . . . 0.32000000000000001 112.631 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -60.8 -54.48 44.64 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.908 -0.404 . . . . 1.8100000000000001 109.908 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.461 ' HG ' ' HB3' ' A' ' 60' ' ' LEU . 1.5 tm? -70.21 -32.14 69.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.842 0.353 . . . . 0.38 110.923 -177.635 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.449 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -66.64 -44.98 80.5 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.411 -0.516 . . . . 1.9299999999999999 110.6 -178.741 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.414 ' HG3' ' O ' ' A' ' 73' ' ' GLY . 24.4 mtm-85 -69.4 -33.07 72.45 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.462 0.649 . . . . 3.9199999999999999 109.823 175.023 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' HIS . . . . . 0.402 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 56.6 t60 -58.5 -51.63 69.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.961 -1.018 . . . . 0.48999999999999999 110.465 176.436 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.565 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 32.8 mt -75.57 -18.92 59.61 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.177 -0.465 . . . . 0.51000000000000001 111.109 178.746 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 49.8 ttp180 -58.01 -48.29 80.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.308 -0.405 . . . . 3.4100000000000001 109.966 177.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 38.5 pt -77.22 -25.4 15.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 1.8300000000000001 110.981 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.565 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 21.9 m-70 -65.44 -47.31 76.61 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.831 0.348 . . . . 0.45000000000000001 111.195 176.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.2 m . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 116.233 -0.44 . . . . 1.21 111.405 -177.52 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 87.9 mt . . . . . 0 CA--C 1.515 -0.369 0 CA-C-O 120.735 0.303 . . . . 0.52000000000000002 111.144 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.651 ' HD2' ' HB3' ' A' ' 68' ' ' GLN . 2.5 mptm? -80.39 129.95 34.85 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.324 -0.398 . . . . 1.99 111.053 -176.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 37.1 t -75.33 114.55 13.99 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.711 -0.848 . . . . 0.46000000000000002 108.711 170.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 63' ' ' ARG . 23.7 ttt180 -53.73 -46.13 70.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.402 -0.817 . . . . 3.8599999999999999 112.119 -176.605 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 30.1 mp0 -75.87 -31.36 59.23 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.106 -0.497 . . . . 2.1800000000000002 112.009 -174.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 91.6 m -98.27 -40.47 8.33 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.231 0.456 . . . . 0.32000000000000001 112.231 -174.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 100.43 -0.92 55.75 Favored Glycine 0 N--CA 1.455 -0.098 0 C-N-CA 120.874 -0.679 . . . . 0.40000000000000002 111.824 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -93.1 -175.7 3.94 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 109.303 -0.629 . . . . 1.28 109.303 179.171 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.651 ' HB3' ' HD2' ' A' ' 61' ' ' LYS . 20.6 pt20 -141.38 150.21 42.11 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.001 0.429 . . . . 1.77 111.703 -171.203 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.556 ' CD1' HD23 ' A' ' 75' ' ' LEU . 58.6 m-85 -118.94 177.42 4.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.827 -0.624 . . . . 0.87 109.825 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.4 p -120.26 0.35 10.61 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.171 0.51 . . . . 1.77 111.146 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.652 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 8.3 m -126.71 130.02 49.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.876 -0.602 . . . . 0.90000000000000002 110.163 -175.314 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.419 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 49.6 m -63.23 -51.25 67.0 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.597 -0.729 . . . . 1.4199999999999999 111.646 -177.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.4 -28.6 73.16 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.854 -0.689 . . . . 0.32000000000000001 111.873 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.652 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 41.3 t-20 -64.58 -50.67 66.33 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.705 -0.48 . . . . 1.8100000000000001 109.705 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.556 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.3 tm? -65.78 -38.87 90.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.31 -0.405 . . . . 0.38 110.377 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.8 mmmt -66.04 -47.9 72.86 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.831 -0.348 . . . . 1.9299999999999999 111.18 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.412 ' O ' HG13 ' A' ' 81' ' ' ILE . 42.8 ttm180 -60.06 -41.57 92.65 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.234 0.54 . . . . 3.9199999999999999 109.829 175.751 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -59.97 -45.03 94.02 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.135 -0.939 . . . . 0.48999999999999999 111.273 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.617 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 34.1 mt -78.04 -19.54 54.13 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.666 -0.414 . . . . 0.51000000000000001 110.952 -176.798 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -69.58 -33.08 72.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.03 -0.73 . . . . 3.4100000000000001 109.03 172.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 77' ' ' ARG . 70.7 mt -75.67 -32.06 23.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.392 -0.822 . . . . 1.8300000000000001 110.024 174.487 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.617 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 6.1 m-70 -65.53 -37.54 87.03 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.166 -0.47 . . . . 0.45000000000000001 111.375 176.784 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 51.8 p . . . . . 0 C--N 1.324 -0.512 0 CA-C-O 121.085 0.469 . . . . 1.21 110.68 177.935 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.471 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 95.8 mt . . . . . 0 CA--C 1.516 -0.343 0 N-CA-C 108.299 -1.0 . . . . 0.52000000000000002 108.299 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.762 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 51.8 tttp -80.63 126.23 31.0 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.462 0.649 . . . . 1.99 112.501 -162.206 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 51.2 t -82.32 105.58 13.51 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 115.141 -0.936 . . . . 0.46000000000000002 108.514 174.09 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -62.91 -29.31 70.68 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.776 0.322 . . . . 3.8599999999999999 111.198 -176.32 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -79.4 -30.86 42.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.91 0.337 . . . . 2.1800000000000002 111.91 -176.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 67.0 m -94.91 -41.94 8.93 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.461 0.648 . . . . 0.32000000000000001 110.679 176.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.05 -12.1 34.26 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.092 -0.958 . . . . 0.40000000000000002 111.437 -177.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.573 ' HD2' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -110.83 128.78 55.9 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 122.399 1.095 . . . . 1.28 111.451 -177.048 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.762 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -78.73 164.34 24.65 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 113.333 -1.758 . . . . 1.77 112.75 174.781 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -122.25 143.71 49.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.973 -1.012 . . . . 0.87 110.356 176.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.0 t -91.65 7.03 43.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.075 0.464 . . . . 1.77 110.735 177.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.452 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 3.9 m -126.22 129.57 49.23 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.735 -0.468 . . . . 0.90000000000000002 109.735 179.225 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.471 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 22.8 t -69.51 -50.76 42.13 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.621 -0.718 . . . . 1.4199999999999999 111.733 -172.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.2 -34.94 90.74 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.51 -0.852 . . . . 0.32000000000000001 111.833 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.452 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 4.7 m-20 -62.11 -50.75 70.67 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.576 -0.157 . . . . 1.8100000000000001 110.576 178.077 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.453 HD22 ' O ' ' A' ' 75' ' ' LEU . 0.6 OUTLIER -68.97 -37.01 78.54 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 123.162 0.288 . . . . 0.38 110.796 -177.489 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.556 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -62.44 -52.26 64.24 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.67 -0.412 . . . . 1.9299999999999999 110.47 178.272 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 77' ' ' ARG . 27.9 mtp180 -62.94 -30.4 71.53 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.427 0.632 . . . . 3.9199999999999999 110.414 176.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' HIS . . . . . 0.444 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 69.8 t60 -66.32 -50.81 62.35 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.946 -1.024 . . . . 0.48999999999999999 110.695 178.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.557 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 42.8 mt -75.92 -19.73 58.55 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.769 0.319 . . . . 0.51000000000000001 110.807 179.016 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -58.93 -49.58 77.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.96 -0.564 . . . . 3.4100000000000001 109.798 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.0 tp -73.78 -30.38 28.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.037 -0.529 . . . . 1.8300000000000001 110.47 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.557 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 22.9 m-70 -61.84 -46.44 89.44 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.698 0.285 . . . . 0.45000000000000001 111.109 176.529 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.3 m . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 116.027 -0.533 . . . . 1.21 111.252 -176.109 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.56 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 96.6 mt . . . . . 0 N--CA 1.448 -0.571 0 CA-C-O 121.188 0.518 . . . . 0.52000000000000002 111.167 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 45.5 tptt -81.92 114.03 20.24 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.325 -0.852 . . . . 1.99 109.89 -176.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 41.8 t -70.75 109.53 5.01 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.43 -0.582 . . . . 0.46000000000000002 109.43 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -58.41 -27.3 64.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.802 -0.636 . . . . 3.8599999999999999 111.483 -177.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -93.43 -20.05 20.69 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.747 0.647 . . . . 2.1800000000000002 112.747 -175.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.446 ' HB3' ' HG3' ' A' ' 67' ' ' LYS . 64.4 m -105.87 -41.37 5.43 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.211 0.448 . . . . 0.32000000000000001 112.211 178.336 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.91 -0.08 59.02 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.44 -0.886 . . . . 0.40000000000000002 111.565 -175.511 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.446 ' HG3' ' HB3' ' A' ' 65' ' ' CYS . 0.0 OUTLIER -108.09 -178.36 3.59 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 109.182 -0.673 . . . . 1.28 109.182 176.104 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.56 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 27.6 tt0 -141.68 148.92 39.88 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 111.763 0.283 . . . . 1.77 111.763 -159.322 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.468 ' CD1' HD23 ' A' ' 75' ' ' LEU . 66.5 m-85 -126.19 140.52 52.49 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 120.815 0.341 . . . . 0.87 111.229 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.2 p -84.72 -22.25 29.8 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.281 -0.418 . . . . 1.77 111.406 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 4.6 m -104.72 129.9 52.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.853 -0.612 . . . . 0.90000000000000002 110.411 -177.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.419 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 14.6 m -60.59 -47.87 84.28 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.343 -0.844 . . . . 1.4199999999999999 111.857 -176.378 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.25 -32.97 85.95 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.934 -0.65 . . . . 0.32000000000000001 112.431 -179.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.441 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 5.4 m-20 -62.24 -46.36 89.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.537 0.208 . . . . 1.8100000000000001 110.873 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.468 HD23 ' CD1' ' A' ' 69' ' ' PHE . 2.1 tm? -77.18 -31.8 55.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.545 -0.298 . . . . 0.38 110.592 -177.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.515 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -67.21 -44.95 78.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.659 0.266 . . . . 1.9299999999999999 110.955 177.817 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.463 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 70.7 ttt180 -66.07 -34.61 78.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.579 0.704 . . . . 3.9199999999999999 109.771 174.328 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' HIS . . . . . 0.475 ' O ' HG22 ' A' ' 81' ' ' ILE . 77.6 t60 -65.83 -46.28 79.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.976 -1.011 . . . . 0.48999999999999999 110.689 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.532 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 31.3 mt -74.27 -19.44 60.49 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.674 0.274 . . . . 0.51000000000000001 110.803 177.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.463 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 70.4 ttt180 -60.32 -47.74 84.75 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.282 -0.417 . . . . 3.4100000000000001 109.955 176.587 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.475 HG22 ' O ' ' A' ' 78' ' ' HIS . 11.3 tp -72.88 -25.83 22.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.303 -0.408 . . . . 1.8300000000000001 110.36 177.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.532 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 32.3 m-70 -67.63 -41.44 83.91 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.048 0.452 . . . . 0.45000000000000001 110.683 175.229 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 C--N 1.325 -0.477 0 CA-C-O 121.138 0.494 . . . . 1.21 110.352 179.786 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.588 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 67.0 mt . . . . . 0 CA--C 1.515 -0.398 0 CA-C-O 120.649 0.261 . . . . 0.52000000000000002 110.676 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.502 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 11.4 tppt? -80.85 128.31 33.53 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.091 -0.504 . . . . 1.99 112.188 -171.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 41.2 t -90.9 99.29 12.35 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.577 -1.268 . . . . 0.46000000000000002 107.577 166.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -63.78 -24.82 67.92 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 111.893 0.331 . . . . 3.8599999999999999 111.893 -173.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -76.46 -30.61 57.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.677 -0.238 . . . . 2.1800000000000002 111.489 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 67.6 m -97.5 -41.54 8.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.161 0.505 . . . . 0.32000000000000001 111.141 178.19 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.55 6.5 50.19 Favored Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 110.827 -0.909 . . . . 0.40000000000000002 110.827 -178.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.463 ' HE3' ' HE1' ' A' ' 69' ' ' PHE . 25.1 pttt -108.07 -177.57 3.37 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 108.972 -0.751 . . . . 1.28 108.972 -177.774 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.588 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 50.1 mt-30 -137.31 163.44 30.98 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 116.03 -0.532 . . . . 1.77 110.593 -174.298 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.542 ' CD1' HD23 ' A' ' 75' ' ' LEU . 14.1 m-85 -132.73 131.33 41.08 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-O 121.121 0.486 . . . . 0.87 110.885 -177.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.7 m -67.68 -26.69 66.32 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 114.799 -1.092 . . . . 1.77 112.529 -174.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.4 m -114.28 130.0 56.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.108 0.48 . . . . 0.90000000000000002 110.255 -178.166 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.533 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.2 m -56.4 -45.53 80.59 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 114.997 -1.001 . . . . 1.4199999999999999 111.825 -176.528 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.87 -34.51 90.12 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.634 -0.793 . . . . 0.32000000000000001 112.086 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 4.1 m-20 -63.05 -44.96 94.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.212 0.054 . . . . 1.8100000000000001 110.882 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.542 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.4 tm? -72.03 -38.39 69.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.847 0.356 . . . . 0.38 110.176 -178.518 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.594 ' O ' ' HG3' ' A' ' 80' ' ' ARG . 0.1 OUTLIER -62.53 -50.7 70.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.326 -0.397 . . . . 1.9299999999999999 110.016 178.874 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -59.14 -40.97 87.17 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.627 0.727 . . . . 3.9199999999999999 110.354 175.221 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' HIS . . . . . 0.436 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 77.2 t60 -58.04 -42.82 86.2 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.527 -1.215 . . . . 0.48999999999999999 111.119 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.473 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 53.7 mt -79.66 -19.17 49.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.174 -0.466 . . . . 0.51000000000000001 111.836 -177.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.594 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 25.4 mtp180 -62.75 -41.76 99.36 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.978 -0.749 . . . . 3.4100000000000001 108.978 173.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 73.0 mt -65.61 -40.19 87.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.049 -0.978 . . . . 1.8300000000000001 110.446 176.07 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.473 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 31.5 m-70 -65.65 -31.89 73.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.896 -0.593 . . . . 0.45000000000000001 111.858 178.599 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.5 m . . . . . 0 C--N 1.324 -0.539 0 CA-C-O 120.717 0.294 . . . . 1.21 111.069 -178.079 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.668 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 61.1 mt . . . . . 0 CA--C 1.512 -0.491 0 CA-C-O 120.976 0.417 . . . . 0.52000000000000002 111.076 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.669 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 15.7 ttpt -82.32 134.2 35.26 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.261 0.553 . . . . 1.99 111.033 -175.815 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 49.4 t -87.27 96.57 10.39 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 108.166 -1.05 . . . . 0.46000000000000002 108.166 173.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -50.77 -37.71 43.82 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.528 0.517 . . . . 3.8599999999999999 110.877 179.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.6 mp0 -65.06 -38.77 91.88 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.426 -0.806 . . . . 2.1800000000000002 112.089 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.475 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 62.7 m -97.16 -41.16 8.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.124 0.488 . . . . 0.32000000000000001 111.544 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 105.63 0.12 39.78 Favored Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 111.087 -0.805 . . . . 0.40000000000000002 111.087 -177.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.574 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 14.8 ptmt -95.9 -178.39 4.34 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 115.064 -0.568 . . . . 1.28 109.905 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.669 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 26.6 tt0 -149.04 143.69 26.24 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 116.12 -0.491 . . . . 1.77 110.728 -174.382 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.552 ' CD1' HD23 ' A' ' 75' ' ' LEU . 53.9 m-85 -113.61 -173.99 2.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.977 -0.556 . . . . 0.87 109.803 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.5 t -134.87 18.86 3.5 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.44 0.638 . . . . 1.77 110.075 175.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 88.6 m -137.89 128.65 26.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.90000000000000002 110.01 -178.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.668 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 5.3 p -64.14 -59.71 4.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.142 -0.935 . . . . 1.4199999999999999 112.356 -175.497 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.18 -34.87 81.8 Favored Glycine 0 C--O 1.229 -0.177 0 C-N-CA 121.003 -0.618 . . . . 0.32000000000000001 112.819 -177.465 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -65.08 -48.07 75.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.624 -0.139 . . . . 1.8100000000000001 110.624 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.552 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.5 tm? -70.09 -37.78 75.5 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.564 -0.289 . . . . 0.38 110.446 -178.788 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.665 ' O ' ' HG2' ' A' ' 80' ' ' ARG . 7.8 mmpt? -61.19 -49.64 76.36 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.115 -0.328 . . . . 1.9299999999999999 110.115 177.138 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -60.34 -40.72 91.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.453 0.644 . . . . 3.9199999999999999 110.264 175.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' HIS . . . . . 0.423 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 74.4 t60 -56.04 -44.97 79.31 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.003 -0.998 . . . . 0.48999999999999999 110.732 177.307 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.564 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 45.9 mt -80.17 -18.65 49.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.245 -0.434 . . . . 0.51000000000000001 111.637 -178.482 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.665 ' HG2' ' O ' ' A' ' 76' ' ' LYS . 4.5 mmp_? -60.83 -45.49 94.27 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.91 -0.774 . . . . 3.4100000000000001 108.91 171.413 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 66.8 mt -60.15 -41.3 86.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.154 -0.93 . . . . 1.8300000000000001 109.963 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.564 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 39.6 m-70 -65.97 -15.19 62.78 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.879 -0.601 . . . . 0.45000000000000001 111.632 177.642 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 33.8 t . . . . . 0 C--N 1.324 -0.531 0 CA-C-O 120.827 0.346 . . . . 1.21 110.764 179.413 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.953 ' HB3' HD12 ' A' ' 75' ' ' LEU . 75.6 mt . . . . . 0 C--O 1.219 -0.517 0 N-CA-C 109.876 -0.416 . . . . 0.52000000000000002 109.876 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 10.5 tptm -127.12 127.0 43.9 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 120.897 0.379 . . . . 1.99 110.318 -178.275 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.731 ' SG ' ' CD2' ' A' ' 78' ' ' HIS . 0.5 OUTLIER -100.08 79.62 2.2 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 108.395 -0.965 . . . . 0.46000000000000002 108.395 -176.214 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -51.1 -36.47 40.56 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 113.176 0.806 . . . . 3.8599999999999999 113.176 -169.058 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.721 ' CD ' ' H ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER -65.98 -35.74 81.41 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.984 0.421 . . . . 2.1800000000000002 110.33 178.614 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.401 ' HB2' ' HB3' ' A' ' 62' ' ' CYS . 72.5 m -92.59 -40.61 10.68 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.9 -0.591 . . . . 0.32000000000000001 110.659 -176.041 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.9 11.48 49.77 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.718 -0.953 . . . . 0.40000000000000002 110.718 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.517 ' HE3' ' CE1' ' A' ' 69' ' ' PHE . 46.0 pttt -108.0 -176.53 3.08 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 114.913 -0.644 . . . . 1.28 109.661 -177.041 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -138.36 156.45 47.59 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 115.514 -0.766 . . . . 1.77 109.707 -175.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.723 ' CD1' ' HG ' ' A' ' 75' ' ' LEU . 41.8 m-85 -123.4 164.33 19.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.983 0.42 . . . . 0.87 110.683 178.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.2 t -121.21 9.89 10.54 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.47 -0.937 . . . . 1.77 108.47 173.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.471 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 32.0 m -137.74 127.82 25.9 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.739 -1.119 . . . . 0.90000000000000002 109.956 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.413 ' HA ' HD11 ' A' ' 60' ' ' LEU . 19.9 t -71.18 -43.47 67.37 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.81 -0.632 . . . . 1.4199999999999999 110.816 -177.725 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.2 -28.8 73.46 Favored Glycine 0 C--N 1.331 0.291 0 C-N-CA 120.907 -0.664 . . . . 0.32000000000000001 112.678 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.471 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 34.3 m-20 -68.84 -51.57 39.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.456 0.17 . . . . 1.8100000000000001 110.676 177.733 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.953 HD12 ' HB3' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -67.46 -37.58 83.17 Favored 'General case' 0 C--O 1.223 -0.323 0 N-CA-C 109.753 -0.462 . . . . 0.38 109.753 179.508 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.569 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -54.73 -52.64 61.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.91 0.386 . . . . 1.9299999999999999 110.765 177.417 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -63.09 -40.53 97.92 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.321 0.581 . . . . 3.9199999999999999 110.888 179.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' HIS . . . . . 0.731 ' CD2' ' SG ' ' A' ' 62' ' ' CYS . 78.0 t60 -69.5 -28.68 66.27 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.527 -0.761 . . . . 0.48999999999999999 111.063 -178.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.674 ' HG ' HD22 ' A' ' 75' ' ' LEU . 79.7 mt -74.52 -28.24 60.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.92 0.391 . . . . 0.51000000000000001 110.768 173.802 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -62.27 -42.26 99.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.018 -0.537 . . . . 3.4100000000000001 109.928 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.9 tt -76.31 -24.7 16.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 116.27 -0.423 . . . . 1.8300000000000001 110.725 176.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.559 ' NE2' ' NE2' ' A' ' 78' ' ' HIS . 11.6 m-70 -66.69 -36.51 82.67 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.795 0.331 . . . . 0.45000000000000001 110.599 174.482 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.6 m . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.043 0.449 . . . . 1.21 111.085 178.196 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.534 HD12 ' HA ' ' A' ' 72' ' ' SER . 80.4 mt . . . . . 0 CA--C 1.515 -0.404 0 N-CA-C 110.195 -0.298 . . . . 0.52000000000000002 110.195 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 2.4 mppt? -82.28 133.93 35.26 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.568 0.699 . . . . 1.99 111.663 -174.064 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.436 ' SG ' ' HB2' ' A' ' 64' ' ' GLU . 44.8 t -78.05 97.26 5.33 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 114.782 -1.099 . . . . 0.46000000000000002 108.087 170.691 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -56.22 -22.74 31.26 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.201 0.524 . . . . 3.8599999999999999 111.132 -177.554 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.436 ' HB2' ' SG ' ' A' ' 62' ' ' CYS . 16.3 mm-40 -72.44 -37.37 68.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.917 -0.583 . . . . 2.1800000000000002 111.339 177.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.459 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 89.4 m -107.77 -41.45 5.0 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.594 0.59 . . . . 0.32000000000000001 112.594 -173.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.89 -6.46 32.88 Favored Glycine 0 N--CA 1.452 -0.246 0 N-CA-C 111.416 -0.674 . . . . 0.40000000000000002 111.416 -176.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.497 ' O ' ' HA ' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -85.67 -178.17 6.57 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 122.982 0.513 . . . . 1.28 109.655 178.961 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.52 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 20.0 pt20 -145.35 153.84 41.67 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 116.015 -0.539 . . . . 1.77 111.37 -172.254 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.512 ' CD1' HD23 ' A' ' 75' ' ' LEU . 56.9 m-85 -135.8 121.93 20.22 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.288 -0.415 . . . . 0.87 109.93 176.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.7 t -71.92 -10.81 60.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.113 0.483 . . . . 1.77 111.083 -177.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 18.7 m -110.76 129.85 55.73 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.985 -0.552 . . . . 0.90000000000000002 110.218 178.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.534 ' HA ' HD12 ' A' ' 60' ' ' LEU . 49.2 m -65.81 -41.9 91.31 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.441 -0.8 . . . . 1.4199999999999999 112.306 -173.692 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.04 -36.02 92.73 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.057 -0.592 . . . . 0.32000000000000001 112.583 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -62.99 -50.24 71.51 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.401 -0.222 . . . . 1.8100000000000001 110.401 178.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.512 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.1 tm? -68.19 -33.47 74.49 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.389 -0.369 . . . . 0.38 110.304 -178.035 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.557 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -65.46 -51.25 61.49 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.654 0.264 . . . . 1.9299999999999999 110.459 178.045 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.479 ' HD3' ' O ' ' A' ' 77' ' ' ARG . 3.6 tmt_? -64.26 -34.49 78.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.313 0.578 . . . . 3.9199999999999999 109.445 176.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -60.37 -51.92 67.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.452 -0.794 . . . . 0.48999999999999999 110.94 177.437 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.476 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 31.3 mt -75.28 -19.66 59.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.384 -0.371 . . . . 0.51000000000000001 111.315 -179.066 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.471 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 42.7 ttm180 -55.99 -54.89 39.35 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.445 -0.576 . . . . 3.4100000000000001 109.445 171.746 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 45.9 mm -57.74 -40.29 74.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.68 -0.691 . . . . 1.8300000000000001 109.956 178.409 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.476 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 45.4 m-70 -64.01 -28.01 69.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.562 -0.744 . . . . 0.45000000000000001 112.091 178.575 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.1 m . . . . . 0 C--N 1.325 -0.49 0 CA-C-O 120.674 0.273 . . . . 1.21 111.455 -176.061 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.564 HD12 ' HA ' ' A' ' 72' ' ' SER . 91.6 mt . . . . . 0 CA--C 1.516 -0.356 0 CA-C-O 120.947 0.403 . . . . 0.52000000000000002 110.782 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.1 tppt? -82.91 140.18 32.98 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.819 -0.628 . . . . 1.99 111.526 -174.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 45.7 t -96.86 95.38 7.82 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 107.746 -1.205 . . . . 0.46000000000000002 107.746 164.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.3 ttp180 -52.17 -36.3 51.33 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 123.398 0.436 . . . . 3.8599999999999999 111.748 -177.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -71.62 -35.13 70.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.1 -0.5 . . . . 2.1800000000000002 111.355 -175.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.441 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 65.3 m -94.02 -41.48 9.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.168 0.509 . . . . 0.32000000000000001 111.364 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 103.71 6.03 44.17 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 111.205 -0.758 . . . . 0.40000000000000002 111.205 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.558 ' HE2' ' CZ ' ' A' ' 69' ' ' PHE . 11.5 ptmt -101.41 -177.31 3.4 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.101 -0.549 . . . . 1.28 109.912 -178.286 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.43 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 35.6 tt0 -150.86 142.23 23.37 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.748 -0.66 . . . . 1.77 110.078 -168.716 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.638 ' CD1' HD23 ' A' ' 75' ' ' LEU . 88.1 m-85 -123.6 150.64 43.87 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-O 120.824 0.345 . . . . 0.87 111.09 -174.068 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.4 p -90.91 -25.26 19.9 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.164 -0.471 . . . . 1.77 111.69 -177.247 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.486 HG23 ' CB ' ' A' ' 74' ' ' ASN . 0.5 OUTLIER -108.72 132.7 53.69 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.588 0.709 . . . . 0.90000000000000002 110.648 -179.825 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.564 ' HA ' HD12 ' A' ' 60' ' ' LEU . 66.2 m -64.57 -43.8 92.73 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 114.763 -1.108 . . . . 1.4199999999999999 111.787 -174.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.62 -33.47 86.74 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.574 -0.822 . . . . 0.32000000000000001 112.326 -177.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.503 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 62.0 t30 -69.29 -40.56 77.64 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.096 -0.242 . . . . 1.8100000000000001 110.371 -179.227 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.638 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.6 tm? -76.47 -34.68 58.68 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.586 0.231 . . . . 0.38 110.552 -179.054 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.571 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 8.8 mmpt? -64.85 -46.58 81.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.652 0.263 . . . . 1.9299999999999999 110.35 177.343 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -60.95 -41.72 96.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.694 0.759 . . . . 3.9199999999999999 109.736 174.093 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' HIS . . . . . 0.503 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 61.3 t60 -58.51 -46.88 85.81 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.292 -1.322 . . . . 0.48999999999999999 111.23 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.563 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 28.8 mt -83.81 -18.86 36.24 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 111.919 0.34 . . . . 0.51000000000000001 111.919 -176.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -61.86 -48.18 81.67 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.803 -0.443 . . . . 3.4100000000000001 109.803 174.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 13.9 tt -70.14 -29.46 39.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.3 -0.409 . . . . 1.8300000000000001 110.481 178.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.563 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 7.3 m80 -63.65 -29.54 70.76 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.008 0.432 . . . . 0.45000000000000001 110.29 173.172 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 47.5 m . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 115.986 -0.552 . . . . 1.21 111.126 -178.984 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.695 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 67.9 mt . . . . . 0 CA--C 1.515 -0.396 0 CA-C-O 121.07 0.462 . . . . 0.52000000000000002 111.809 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 40.8 tptt -81.4 126.14 31.26 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.214 -0.903 . . . . 1.99 111.151 -172.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 28.8 t -80.39 117.29 21.01 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.721 -0.844 . . . . 0.46000000000000002 108.721 171.337 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -60.23 -34.97 74.42 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.661 0.615 . . . . 3.8599999999999999 112.661 -172.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -94.1 -21.59 19.02 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.64 -0.424 . . . . 2.1800000000000002 111.943 -172.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.417 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 84.3 m -99.35 -41.07 7.59 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.648 -0.421 . . . . 0.32000000000000001 111.961 -179.66 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.58 2.52 58.69 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.707 -0.758 . . . . 0.40000000000000002 111.517 -177.447 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.677 ' HE3' ' CE1' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -90.7 -176.72 4.8 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 109.764 -0.458 . . . . 1.28 109.764 178.429 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.695 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 28.2 pt20 -150.0 148.35 28.95 Favored 'General case' 0 C--N 1.309 -1.196 0 CA-C-N 115.898 -0.592 . . . . 1.77 111.114 -173.875 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.677 ' CE1' ' HE3' ' A' ' 67' ' ' LYS . 32.1 m-85 -122.44 133.29 54.62 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.315 -0.402 . . . . 0.87 111.51 -176.501 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.4 t -74.14 -16.28 61.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.329 0.585 . . . . 1.77 110.32 177.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.53 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 13.1 m -109.91 128.95 55.68 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.047 -0.524 . . . . 0.90000000000000002 110.136 177.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.558 ' HA ' HD12 ' A' ' 60' ' ' LEU . 42.5 t -69.16 -40.76 77.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.513 -0.767 . . . . 1.4199999999999999 110.901 -176.288 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.36 -38.49 95.03 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.656 -0.783 . . . . 0.32000000000000001 111.983 178.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.53 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 39.9 m-20 -61.05 -43.08 99.43 Favored 'General case' 0 C--O 1.221 -0.435 0 C-N-CA 121.434 -0.106 . . . . 1.8100000000000001 110.927 178.505 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.523 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.6 tm? -69.79 -37.37 76.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.816 0.341 . . . . 0.38 110.267 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.544 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -66.96 -45.5 77.57 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.841 -0.344 . . . . 1.9299999999999999 110.11 179.734 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.57 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 4.9 tmt_? -64.99 -33.91 77.18 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.441 0.639 . . . . 3.9199999999999999 109.817 175.05 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' HIS . . . . . 0.433 ' O ' HG22 ' A' ' 81' ' ' ILE . 73.6 t60 -63.92 -43.77 94.92 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.307 -0.861 . . . . 0.48999999999999999 110.616 177.207 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.602 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 44.1 mt -80.05 -18.59 49.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.942 0.401 . . . . 0.51000000000000001 110.635 178.821 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.57 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 28.7 tpt180 -56.31 -47.61 78.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.021 -0.536 . . . . 3.4100000000000001 109.936 172.501 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.433 HG22 ' O ' ' A' ' 78' ' ' HIS . 9.0 tp -74.7 -27.35 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 120.647 -0.421 . . . . 1.8300000000000001 110.606 178.452 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.602 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 28.5 m-70 -65.63 -26.03 67.64 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.087 0.47 . . . . 0.45000000000000001 110.955 174.153 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 56.7 m . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 115.981 -0.554 . . . . 1.21 110.523 176.581 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.681 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 99.5 mt . . . . . 0 CA--C 1.513 -0.477 0 CA-C-O 120.631 0.253 . . . . 0.52000000000000002 110.62 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 67' ' ' LYS . 5.5 tppp? -81.8 129.75 34.84 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.246 -0.434 . . . . 1.99 111.627 -172.361 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 19.5 t -82.5 128.77 34.6 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 108.688 -0.856 . . . . 0.46000000000000002 108.688 169.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.511 ' HA ' ' NE ' ' A' ' 63' ' ' ARG . 1.2 mmp_? -71.14 -38.88 72.23 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.109 -0.496 . . . . 3.8599999999999999 111.973 -172.217 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -90.46 -12.27 37.86 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.164 0.431 . . . . 2.1800000000000002 112.164 -174.69 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.482 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 99.1 m -109.67 -41.72 4.48 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.652 -0.419 . . . . 0.32000000000000001 111.703 178.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 96.19 1.3 61.12 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.513 -0.851 . . . . 0.40000000000000002 111.698 -177.105 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.501 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 17.9 ptmt -88.28 -177.72 5.74 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 122.816 0.446 . . . . 1.28 110.126 179.597 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.681 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 57.3 mt-30 -145.14 144.11 30.72 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.733 -0.667 . . . . 1.77 111.405 -170.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.552 ' CD1' HD23 ' A' ' 75' ' ' LEU . 50.4 m-85 -123.1 135.92 54.58 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.162 -0.472 . . . . 0.87 111.454 -178.855 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.6 p -83.67 -4.52 58.67 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.256 -0.429 . . . . 1.77 111.448 -178.532 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.488 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 28.5 m -123.76 129.64 51.38 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.981 -0.554 . . . . 0.90000000000000002 109.924 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.1 t -61.11 -52.89 62.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.416 -0.811 . . . . 1.4199999999999999 111.579 -175.165 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.95 -29.22 71.89 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.883 -0.675 . . . . 0.32000000000000001 112.424 179.635 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.488 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 5.0 m-20 -66.39 -37.74 85.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.565 0.221 . . . . 1.8100000000000001 110.672 178.72 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.552 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.8 tm? -81.06 -32.01 34.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.373 -0.376 . . . . 0.38 110.299 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.564 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -67.39 -47.0 71.61 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.754 0.279 . . . . 1.9299999999999999 111.754 179.148 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -31.74 73.09 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.9 0.857 . . . . 3.9199999999999999 109.092 176.74 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' HIS . . . . . 0.422 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 72.7 t60 -65.29 -52.09 56.49 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.229 -1.35 . . . . 0.48999999999999999 110.45 179.521 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.512 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 19.3 mt -76.28 -18.65 58.88 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.083 -0.508 . . . . 0.51000000000000001 111.295 -179.048 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -55.44 -47.06 76.61 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.194 -0.669 . . . . 3.4100000000000001 109.194 170.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 47.7 mm -61.8 -41.57 91.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.415 -0.812 . . . . 1.8300000000000001 110.314 175.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.512 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 62.7 m-70 -70.12 -23.81 63.08 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.8 -0.637 . . . . 0.45000000000000001 112.542 -177.541 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 22.2 m . . . . . 0 C--N 1.326 -0.426 0 CA-C-O 120.908 0.385 . . . . 1.21 111.062 -178.903 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.694 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 83.6 mt . . . . . 0 CA--C 1.516 -0.338 0 CA-C-O 120.676 0.274 . . . . 0.52000000000000002 111.001 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.567 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 48.5 tptt -81.82 122.24 27.46 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.839 -0.619 . . . . 1.99 111.888 -171.062 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 42.3 t -91.73 96.9 10.68 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 107.406 -1.331 . . . . 0.46000000000000002 107.406 169.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 63' ' ' ARG . 59.7 mtt85 -57.49 -30.94 65.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.07 0.462 . . . . 3.8599999999999999 110.973 -177.361 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -69.18 -37.29 78.07 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.7 -0.682 . . . . 2.1800000000000002 110.987 -176.472 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' CYS . . . . . 0.418 ' HB3' ' HD3' ' A' ' 67' ' ' LYS . 67.7 m -94.57 -42.13 8.97 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 121.639 0.733 . . . . 0.32000000000000001 111.2 177.252 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.63 3.01 43.54 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-N 114.891 -1.05 . . . . 0.40000000000000002 111.32 -177.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.418 ' HD3' ' HB3' ' A' ' 65' ' ' CYS . 18.1 pttt -108.36 -178.24 3.55 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-O 120.886 0.374 . . . . 1.28 110.07 -176.644 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.694 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 79.6 mt-30 -141.35 147.28 37.83 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.718 -0.674 . . . . 1.77 111.356 -168.788 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.468 ' CD1' HD23 ' A' ' 75' ' ' LEU . 54.1 m-85 -126.81 125.0 40.97 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.403 -0.362 . . . . 0.87 111.256 -176.165 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.7 p -68.42 -22.21 64.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.369 -0.378 . . . . 1.77 111.877 -176.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.01 129.28 48.26 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.227 0.537 . . . . 0.90000000000000002 110.644 179.223 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.557 ' O ' ' HG2' ' A' ' 76' ' ' LYS . 40.7 t -65.59 -43.77 88.68 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.283 -0.871 . . . . 1.4199999999999999 111.039 -176.938 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.44 ' O ' ' HG3' ' A' ' 77' ' ' ARG . . . -68.72 -33.35 75.69 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.901 -0.666 . . . . 0.32000000000000001 111.983 179.049 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -57.68 -45.14 86.0 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.347 -0.612 . . . . 1.8100000000000001 109.347 176.245 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.468 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.2 tm? -71.04 -31.25 67.66 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.702 -0.681 . . . . 0.38 110.379 179.25 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.557 ' HG2' ' O ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -65.04 -50.75 65.01 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.886 0.374 . . . . 1.9299999999999999 109.999 176.851 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 73' ' ' GLY . 81.3 mtt180 -59.28 -39.19 82.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.673 0.749 . . . . 3.9199999999999999 109.573 174.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -63.18 -36.92 85.22 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.625 -1.17 . . . . 0.48999999999999999 111.45 -177.681 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.531 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 37.1 mt -85.74 -23.85 27.16 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 122.212 -0.305 . . . . 0.51000000000000001 111.242 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 46.3 ttp180 -59.11 -38.64 80.04 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.924 -0.398 . . . . 3.4100000000000001 109.924 173.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 17.2 tt -82.22 -26.15 9.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 C-N-CA 120.83 -0.348 . . . . 1.8300000000000001 110.564 178.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.531 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 4.7 m80 -66.29 -47.19 74.42 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.801 0.334 . . . . 0.45000000000000001 110.842 175.78 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.4 m . . . . . 0 C--N 1.32 -0.7 0 CA-C-N 116.295 -0.411 . . . . 1.21 110.962 -179.131 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.473 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 62.1 mt . . . . . 0 CA--C 1.512 -0.506 0 CA-C-O 121.196 0.522 . . . . 0.52000000000000002 111.397 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.9 tptm -82.04 129.59 34.84 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.3 -0.864 . . . . 1.99 110.572 -174.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 47.3 t -86.39 97.07 10.24 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 108.119 -1.067 . . . . 0.46000000000000002 108.119 172.824 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 mtp180 -59.47 -23.77 63.01 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.721 0.296 . . . . 3.8599999999999999 111.56 -175.195 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -84.56 -20.97 30.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.531 -0.304 . . . . 2.1800000000000002 111.425 -178.44 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 55.4 m -107.2 -41.97 4.98 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.923 0.392 . . . . 0.32000000000000001 111.769 178.538 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.72 -3.11 42.04 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.742 -0.742 . . . . 0.40000000000000002 111.722 -179.187 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.42 -176.85 3.19 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 109.54 -0.541 . . . . 1.28 109.54 178.454 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -139.81 149.89 44.05 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 116.126 -0.488 . . . . 1.77 110.492 -162.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.489 ' CD1' HD23 ' A' ' 75' ' ' LEU . 55.7 m-85 -117.27 179.76 3.95 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 116.345 -0.389 . . . . 0.87 110.476 -179.299 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 25.4 p -129.54 17.83 5.84 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.129 0.49 . . . . 1.77 111.051 -179.25 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.631 ' HB ' ' CB ' ' A' ' 74' ' ' ASN . 22.7 m -141.97 129.46 21.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.92 -0.582 . . . . 0.90000000000000002 109.767 -179.019 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.473 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 11.9 m -66.2 -42.08 89.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.644 -0.707 . . . . 1.4199999999999999 111.296 -175.536 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.61 -35.42 59.21 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.449 -0.882 . . . . 0.32000000000000001 111.953 177.687 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.631 ' CB ' ' HB ' ' A' ' 71' ' ' THR . 43.6 t-20 -58.59 -50.68 72.94 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.706 0.289 . . . . 1.8100000000000001 110.319 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.489 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.2 tm? -75.41 -32.49 60.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.112 -0.495 . . . . 0.38 111.184 -175.408 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.61 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -69.7 -45.11 68.99 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.84 -0.744 . . . . 1.9299999999999999 110.186 -178.575 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 9.7 tpp180 -62.7 -33.51 75.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.758 0.79 . . . . 3.9199999999999999 109.414 174.392 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' HIS . . . . . 0.435 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 65.8 t60 -65.0 -39.0 92.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.421 -1.263 . . . . 0.48999999999999999 110.706 177.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.505 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 54.3 mt -81.83 -23.63 36.32 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.534 -0.303 . . . . 0.51000000000000001 111.808 -179.446 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -62.28 -40.09 95.1 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.678 -0.489 . . . . 3.4100000000000001 109.678 173.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.5 tt -83.25 -10.82 11.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-O 121.07 0.462 . . . . 1.8300000000000001 110.86 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.505 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 13.6 m-70 -86.35 -47.3 9.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.263 -0.426 . . . . 0.45000000000000001 110.501 173.607 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.0 m . . . . . 0 C--N 1.322 -0.619 0 CA-C-N 116.034 -0.53 . . . . 1.21 111.056 -174.024 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 88.7 mt . . . . . 0 N--CA 1.452 -0.364 0 N-CA-C 110.309 -0.256 . . . . 0.52000000000000002 110.309 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.929 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 24.4 mtmm -78.99 130.19 35.27 Favored 'General case' 0 CA--C 1.511 -0.529 0 C-N-CA 120.389 -0.524 . . . . 1.99 110.806 -175.673 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 35.7 t -68.35 110.29 4.03 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 108.593 -0.891 . . . . 0.46000000000000002 108.593 170.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 ttp180 -57.93 -30.43 65.94 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 123.171 0.294 . . . . 3.8599999999999999 111.741 -175.46 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -85.29 -26.78 26.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.57 -0.286 . . . . 2.1800000000000002 111.663 -174.577 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 93.6 m -103.15 -40.24 6.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.968 0.413 . . . . 0.32000000000000001 111.278 -178.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.75 -1.11 52.32 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 121.141 -0.552 . . . . 0.40000000000000002 112.043 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.4 ' HE3' ' CE1' ' A' ' 78' ' ' HIS . 0.0 OUTLIER -108.95 129.86 55.44 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 122.129 0.966 . . . . 1.28 110.739 -179.802 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.929 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 12.1 pt20 -81.33 161.9 23.65 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 113.384 -1.735 . . . . 1.77 112.917 -176.772 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.586 ' CD1' HD23 ' A' ' 75' ' ' LEU . 34.1 m-85 -130.92 131.8 44.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.702 -1.136 . . . . 0.87 109.446 176.128 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.7 t -84.05 -4.53 58.82 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.005 0.431 . . . . 1.77 111.147 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.2 m -115.52 129.27 56.48 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.264 0.554 . . . . 0.90000000000000002 110.201 179.245 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.8 p -65.65 -50.06 66.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.177 -0.919 . . . . 1.4199999999999999 111.854 -175.824 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.65 -29.52 67.17 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.839 -0.696 . . . . 0.32000000000000001 112.575 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.462 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 6.0 m120 -68.59 -55.02 12.98 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.327 0.108 . . . . 1.8100000000000001 110.766 176.709 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.586 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.1 tm? -69.82 -32.23 70.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.624 -0.262 . . . . 0.38 111.123 -175.411 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 20.8 mmmt -67.68 -51.62 47.49 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.733 -0.387 . . . . 1.9299999999999999 111.328 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -64.68 -29.13 70.12 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.592 0.71 . . . . 3.9199999999999999 109.565 176.322 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' HIS . . . . . 0.462 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 53.3 t60 -64.44 -48.86 73.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.972 -1.013 . . . . 0.48999999999999999 110.587 177.005 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.497 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 33.1 mt -79.49 -19.55 49.44 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.723 0.296 . . . . 0.51000000000000001 111.04 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 -58.54 -48.68 80.06 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.062 -0.517 . . . . 3.4100000000000001 110.385 175.014 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.0 tt -72.3 -30.14 34.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.459 -0.337 . . . . 1.8300000000000001 110.326 178.486 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' HIS . . . . . 0.497 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 13.6 m80 -64.21 -41.24 97.13 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.104 0.478 . . . . 0.45000000000000001 110.791 174.747 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 115.965 -0.561 . . . . 1.21 110.589 179.954 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.598 ' N ' ' HG1' ' A' ' 70' ' ' THR . . . . . . . . 0 N--CA 1.481 1.649 0 CA-C-O 119.818 -0.434 . . . . 1.54 112.183 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.718 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 78.9 Cg_exo -42.94 115.09 0.5 Allowed 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 123.008 2.472 . . . . 1.27 112.828 173.056 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 95.5 mt -118.48 104.55 10.8 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.812 -1.085 . . . . 0.52000000000000002 110.821 176.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.406 ' HD3' ' O ' ' A' ' 67' ' ' LYS . 15.2 tppt? -81.77 128.75 34.32 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.489 -0.778 . . . . 1.99 110.865 -174.268 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 43.2 t -91.47 101.91 14.58 Favored 'General case' 0 N--CA 1.439 -0.989 0 N-CA-C 108.617 -0.883 . . . . 0.46000000000000002 108.617 171.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -55.75 -31.92 62.97 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.602 0.564 . . . . 3.8599999999999999 111.131 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -73.14 -45.53 56.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.004 -0.544 . . . . 2.1800000000000002 111.479 -177.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.565 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 65.9 m -86.63 -41.08 14.53 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.381 0.61 . . . . 0.32000000000000001 110.712 -176.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.68 -0.56 52.61 Favored Glycine 0 N--CA 1.443 -0.891 0 N-CA-C 110.657 -0.977 . . . . 0.40000000000000002 110.657 -176.112 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.565 ' HG2' ' HB2' ' A' ' 65' ' ' CYS . 18.4 ptmt -92.17 -177.66 4.74 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.067 -0.567 . . . . 1.28 109.894 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.481 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 29.6 tt0 -156.72 137.1 12.97 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.603 -0.726 . . . . 1.77 110.463 -171.318 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.718 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 62.3 m-85 -109.96 -174.69 2.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.226 -0.443 . . . . 0.87 110.132 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.598 ' HG1' ' N ' ' A' ' 58' ' ' GLY . 14.4 t -140.86 17.41 2.31 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.757 0.789 . . . . 1.77 108.948 170.594 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 16.9 m -131.89 128.69 39.11 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.142 -0.936 . . . . 0.90000000000000002 109.555 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.9 t -65.03 -52.37 56.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.982 -1.008 . . . . 1.4199999999999999 112.229 -172.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.57 -40.59 98.05 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.979 -0.629 . . . . 0.32000000000000001 112.899 -176.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -63.65 -47.19 82.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.618 0.209 . . . . 1.8100000000000001 111.455 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.543 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.8 tm? -72.47 -35.72 68.28 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.263 -0.273 . . . . 0.38 110.263 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.1 mmmt -62.6 -52.72 62.26 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.956 -0.298 . . . . 1.9299999999999999 110.958 177.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -61.43 -32.36 72.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.22 0.533 . . . . 3.9199999999999999 110.215 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -65.57 -45.64 82.55 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.394 -0.821 . . . . 0.48999999999999999 110.764 178.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.548 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 23.4 mt -79.77 -19.16 49.33 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.923 0.392 . . . . 0.51000000000000001 110.644 -179.266 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.437 ' HG3' ' O ' ' A' ' 85' ' ' GLU . 32.4 ttt180 -58.8 -47.55 84.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.919 -0.582 . . . . 3.4100000000000001 109.556 173.357 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 65.4 mt -64.1 -41.28 91.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.511 -0.768 . . . . 1.8300000000000001 110.132 176.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.548 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 36.3 m-70 -60.31 -40.35 90.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.641 -0.708 . . . . 0.45000000000000001 111.741 178.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 28.4 m -84.82 -29.9 24.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.338 -0.392 . . . . 1.21 111.572 -176.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 83.95 5.81 87.38 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.947 -0.644 . . . . 1.25 111.527 -176.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.437 ' O ' ' HG3' ' A' ' 80' ' ' ARG . 6.2 mm-40 -107.35 -171.78 1.95 Allowed 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 122.584 0.354 . . . . 3.1800000000000002 110.959 -177.098 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.573 ' N ' ' HD2' ' A' ' 86' ' ' LYS . 6.8 mptt . . . . . 0 C--O 1.248 0.976 0 CA-C-O 118.803 -0.618 . . . . 6.25 109.801 -175.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.677 0 N-CA-C 111.902 -0.479 . . . . 1.54 111.902 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.672 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 88.3 Cg_exo -41.7 115.21 0.41 Allowed 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 123.423 2.749 . . . . 1.27 113.255 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.524 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 79.6 mt -121.94 116.07 23.7 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.759 -1.109 . . . . 0.52000000000000002 110.604 175.153 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.409 ' HD2' ' O ' ' A' ' 67' ' ' LYS . 21.5 tptm -82.11 128.85 34.54 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.552 -0.749 . . . . 1.99 111.279 -171.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 54.1 t -89.76 106.5 18.51 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 107.715 -1.217 . . . . 0.46000000000000002 107.715 171.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.4 mtm180 -64.13 -35.88 82.2 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.373 0.606 . . . . 3.8599999999999999 110.013 -175.11 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -68.02 -36.01 79.25 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.931 -1.031 . . . . 2.1800000000000002 111.381 -177.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 90.4 m -97.44 -42.07 7.9 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.088 0.471 . . . . 0.32000000000000001 111.834 -178.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.98 4.52 48.05 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 121.021 -0.609 . . . . 0.40000000000000002 111.622 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.409 ' O ' ' HD2' ' A' ' 61' ' ' LYS . 17.0 ptmt -103.92 -176.28 3.04 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 123.273 0.629 . . . . 1.28 109.354 179.003 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.461 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 17.2 pt20 -148.4 151.86 35.99 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 120.799 0.333 . . . . 1.77 111.247 -174.008 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.672 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 58.8 m-85 -117.58 176.18 5.29 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 116.166 -0.47 . . . . 0.87 110.412 -176.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 76.3 p -112.81 -21.23 11.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.889 0.376 . . . . 1.77 111.535 -177.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.6 p -112.22 134.16 53.93 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.409 0.623 . . . . 0.90000000000000002 111.389 -175.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.524 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 23.3 m -64.01 -46.39 84.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.946 -1.025 . . . . 1.4199999999999999 111.891 -175.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.9 -35.2 78.76 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.43 -0.89 . . . . 0.32000000000000001 112.341 -177.116 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -68.48 -42.68 78.33 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.629 0.252 . . . . 1.8100000000000001 110.693 -176.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.54 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.4 tm? -72.51 -41.29 66.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.516 -0.311 . . . . 0.38 110.825 -179.27 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.51 -41.84 79.4 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.269 -0.572 . . . . 1.9299999999999999 110.766 -177.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -62.15 -36.54 82.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.222 0.534 . . . . 3.9199999999999999 109.788 172.598 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.416 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 82.0 t60 -63.26 -47.84 80.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.376 -0.829 . . . . 0.48999999999999999 111.034 177.329 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.484 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 35.0 mt -73.29 -19.6 61.01 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 121.197 -0.201 . . . . 0.51000000000000001 111.328 -177.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.488 ' HG3' ' O ' ' A' ' 85' ' ' GLU . 73.9 ttt180 -64.91 -38.71 91.86 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.188 -0.671 . . . . 3.4100000000000001 109.188 171.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 54.8 mt -66.08 -37.14 79.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.854 -0.612 . . . . 1.8300000000000001 109.64 176.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.484 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 21.6 m-70 -67.51 -33.76 75.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.449 -0.796 . . . . 0.45000000000000001 111.658 178.254 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 29.2 t -90.91 -55.2 3.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.873 0.368 . . . . 1.21 111.554 -177.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 106.08 -20.44 35.73 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 111.317 -0.713 . . . . 1.25 111.317 -173.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.488 ' O ' ' HG3' ' A' ' 80' ' ' ARG . 6.2 mm-40 -82.89 154.57 24.54 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.785 0.802 . . . . 3.1800000000000002 111.157 -177.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.307 -1.265 0 CA-C-N 114.417 -1.265 . . . . 6.25 110.956 -172.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.792 0 CA-C-O 119.575 -0.569 . . . . 1.54 112.027 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.99 117.94 4.65 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 122.334 2.023 . . . . 1.27 112.177 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 72' ' ' SER . 59.7 mt -117.84 129.03 55.41 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.366 -0.834 . . . . 0.52000000000000002 110.816 176.703 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -82.14 131.38 35.24 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.429 -0.805 . . . . 1.99 111.758 -170.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 48.6 t -97.38 118.2 33.32 Favored 'General case' 0 N--CA 1.438 -1.057 0 N-CA-C 107.795 -1.187 . . . . 0.46000000000000002 107.795 169.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.48 ' HD3' ' H ' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -73.35 -40.45 64.41 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.199 0.523 . . . . 3.8599999999999999 110.141 -174.335 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -66.43 -36.59 83.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.133 -0.939 . . . . 2.1800000000000002 110.798 -176.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 94.2 m -92.6 -41.18 10.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.101 -0.499 . . . . 0.32000000000000001 110.987 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.56 9.89 54.22 Favored Glycine 0 N--CA 1.451 -0.315 0 N-CA-C 111.409 -0.676 . . . . 0.40000000000000002 111.409 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -110.63 -176.25 2.93 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 123.574 0.75 . . . . 1.28 109.532 -178.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.49 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 9.5 pt20 -138.9 156.23 47.44 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 116.012 -0.54 . . . . 1.77 110.887 -177.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.646 ' CD1' HD23 ' A' ' 75' ' ' LEU . 40.1 m-85 -122.04 128.62 51.61 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.165 -0.47 . . . . 0.87 111.106 -178.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -69.23 -14.93 63.24 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.977 -0.556 . . . . 1.77 111.689 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 24.4 m -112.8 129.05 56.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.037 0.446 . . . . 0.90000000000000002 110.274 -178.219 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.518 ' HA ' HD12 ' A' ' 60' ' ' LEU . 7.8 m -69.31 -53.63 18.72 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.401 -0.818 . . . . 1.4199999999999999 112.333 -172.094 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.57 -27.87 73.54 Favored Glycine 0 CA--C 1.508 -0.366 0 C-N-CA 120.697 -0.763 . . . . 0.32000000000000001 112.0 -178.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -66.47 -44.53 82.46 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.855 -0.424 . . . . 1.8100000000000001 109.855 178.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.646 HD23 ' CD1' ' A' ' 69' ' ' PHE . 2.5 tm? -67.7 -39.97 84.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.484 . . . . 0.38 110.067 178.33 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.564 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 3.5 mmpt? -61.9 -43.3 99.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.873 0.368 . . . . 1.9299999999999999 110.829 177.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.461 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 41.6 ttm180 -66.57 -38.82 87.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.164 -0.471 . . . . 3.9199999999999999 110.58 175.157 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -64.02 -47.27 80.92 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.879 -0.601 . . . . 0.48999999999999999 111.433 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.579 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 18.5 mt -75.09 -19.77 59.8 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 121.056 -0.257 . . . . 0.51000000000000001 110.967 -178.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.461 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 0.3 OUTLIER -57.48 -46.13 84.04 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.938 -0.764 . . . . 3.4100000000000001 108.938 170.556 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 52.3 mt -68.18 -38.09 79.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.351 -0.84 . . . . 1.8300000000000001 110.545 178.107 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.579 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 16.5 m-70 -61.84 -31.22 71.45 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.282 -0.417 . . . . 0.45000000000000001 111.311 177.354 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.1 m -80.09 -16.91 53.99 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.083 -0.508 . . . . 1.21 111.157 -178.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 75.84 15.81 81.08 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.965 -0.636 . . . . 1.25 112.125 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -114.1 138.56 50.25 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 109.955 -0.387 . . . . 3.1800000000000002 109.955 -177.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.52 -0.752 . . . . 6.25 109.616 176.734 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.757 0 N-CA-C 112.094 -0.402 . . . . 1.54 112.094 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.597 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 29.0 Cg_endo -64.3 118.0 4.99 Favored 'Trans proline' 0 N--CA 1.454 -0.844 0 C-N-CA 121.882 1.721 . . . . 1.27 110.603 170.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.63 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 75.0 mt -100.81 126.5 47.39 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.258 -0.883 . . . . 0.52000000000000002 111.568 -175.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 36.4 tptt -81.59 117.53 22.04 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.727 -0.669 . . . . 1.99 110.929 -172.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 40.4 t -78.57 112.67 15.88 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.086 -0.709 . . . . 0.46000000000000002 109.086 174.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 63.8 ttt180 -59.95 -36.99 78.25 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.054 -0.521 . . . . 3.8599999999999999 111.43 -177.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.3 mp0 -76.52 -36.01 57.97 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.029 -0.532 . . . . 2.1800000000000002 111.79 -176.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.479 ' HB3' ' HD3' ' A' ' 67' ' ' LYS . 80.1 m -93.34 -41.34 9.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.099 0.476 . . . . 0.32000000000000001 111.584 -177.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.8 -0.75 59.43 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.539 -0.755 . . . . 0.40000000000000002 111.617 -176.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.479 ' HD3' ' HB3' ' A' ' 65' ' ' CYS . 12.2 pttt -103.72 -177.78 3.47 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 108.762 -0.829 . . . . 1.28 108.762 178.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.63 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 7.9 pt20 -145.67 156.5 43.68 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 116.484 -0.325 . . . . 1.77 111.327 -170.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.602 ' CD2' HD23 ' A' ' 75' ' ' LEU . 43.6 m-85 -131.03 137.82 49.35 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-N 116.03 -0.532 . . . . 0.87 111.416 -170.289 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.9 m -72.6 -32.69 66.17 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.48 -0.782 . . . . 1.77 112.011 -173.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.52 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 24.9 m -100.97 128.84 46.82 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.392 0.615 . . . . 0.90000000000000002 110.379 -179.554 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.565 ' HA ' HD12 ' A' ' 60' ' ' LEU . 22.9 t -64.95 -44.71 88.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.211 -0.904 . . . . 1.4199999999999999 110.964 -176.575 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.53 -31.11 79.12 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.842 -0.694 . . . . 0.32000000000000001 112.088 177.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.52 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 5.2 t30 -67.75 -45.58 74.56 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.78 -0.452 . . . . 1.8100000000000001 109.78 178.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.602 HD23 ' CD2' ' A' ' 69' ' ' PHE . 1.5 tm? -68.63 -35.35 77.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.003 -0.544 . . . . 0.38 109.698 178.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.578 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -63.15 -47.83 81.06 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.891 -0.411 . . . . 1.9299999999999999 109.891 177.861 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.493 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 7.8 tpt180 -63.69 -38.7 92.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.29 0.567 . . . . 3.9199999999999999 110.355 175.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -61.48 -41.88 97.94 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.475 -0.784 . . . . 0.48999999999999999 110.502 177.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 31.6 mt -75.85 -19.56 58.8 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.27 -0.423 . . . . 0.51000000000000001 111.349 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.493 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 27.3 ttt85 -61.05 -44.07 97.93 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.587 -0.523 . . . . 3.4100000000000001 109.587 173.391 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 48.2 mm -61.3 -46.19 97.11 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.527 -0.761 . . . . 1.8300000000000001 110.086 175.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -58.26 -43.03 87.69 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.671 -0.695 . . . . 0.45000000000000001 111.436 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.442 ' HB2' ' HG2' ' A' ' 85' ' ' GLU . 24.2 m -73.14 -31.97 64.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.144 -0.48 . . . . 1.21 111.601 -177.29 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 88.44 27.01 26.24 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.673 -0.775 . . . . 1.25 111.587 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.455 ' HB2' ' HG3' ' A' ' 80' ' ' ARG . 48.1 mm-40 -82.47 127.85 33.7 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.027 0.441 . . . . 3.1800000000000002 110.583 -177.113 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.1 pttm . . . . . 0 C--O 1.248 1.001 0 CA-C-N 115.511 -0.768 . . . . 6.25 109.927 173.609 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.57 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . . . . . . 0 N--CA 1.48 1.593 0 N-CA-C 111.663 -0.575 . . . . 1.54 111.663 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.706 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 74.8 Cg_exo -42.22 115.13 0.44 Allowed 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 123.266 2.644 . . . . 1.27 112.814 177.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 58' ' ' GLY . 97.6 mt -128.9 116.55 19.58 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.868 -1.06 . . . . 0.52000000000000002 111.35 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.6 tptp -81.47 132.68 35.33 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.835 -0.621 . . . . 1.99 111.112 -172.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 53.2 t -93.91 116.64 29.11 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.062 -1.088 . . . . 0.46000000000000002 108.062 171.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 46.9 mtp180 -71.9 -37.33 70.13 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.992 0.425 . . . . 3.8599999999999999 111.143 -176.244 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.456 ' OE2' ' HB3' ' A' ' 82' ' ' HIS . 4.5 mp0 -65.6 -35.34 80.53 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.887 -0.597 . . . . 2.1800000000000002 111.734 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.42 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 85.8 m -98.42 -40.5 8.25 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.948 0.404 . . . . 0.32000000000000001 111.512 -178.185 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 103.7 -6.52 48.71 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 111.442 -0.663 . . . . 0.40000000000000002 111.442 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.601 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 17.7 ptmt -90.37 -176.35 4.77 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.058 -0.571 . . . . 1.28 110.438 -177.109 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -143.18 141.43 31.14 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.369 -0.832 . . . . 1.77 109.905 -172.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.706 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 6.6 m-85 -108.53 174.12 6.01 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 110.214 -0.291 . . . . 0.87 110.214 -177.007 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 64.8 p -119.65 -31.74 4.48 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.976 0.417 . . . . 1.77 110.812 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.1 p -97.71 129.34 44.76 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.507 0.67 . . . . 0.90000000000000002 110.815 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.49 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 20.2 p -64.87 -42.84 94.51 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.143 -0.935 . . . . 1.4199999999999999 112.023 -173.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.08 -32.55 76.94 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.551 -0.833 . . . . 0.32000000000000001 112.003 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -67.6 -43.65 80.01 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 121.315 -0.154 . . . . 1.8100000000000001 111.005 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.526 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.5 tm? -74.28 -35.17 63.74 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 121.04 -0.264 . . . . 0.38 110.429 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.558 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -60.5 -55.05 38.11 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.473 0.178 . . . . 1.9299999999999999 111.309 178.384 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -62.57 -30.7 71.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.289 0.566 . . . . 3.9199999999999999 110.045 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -69.21 -43.1 74.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.331 -0.85 . . . . 0.48999999999999999 111.751 -178.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.508 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 18.0 mt -79.15 -23.87 43.69 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.179 -0.609 . . . . 0.51000000000000001 110.801 -178.326 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.689 ' HG3' ' HB3' ' A' ' 85' ' ' GLU . 77.5 ttt180 -58.27 -47.66 82.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.091 -0.504 . . . . 3.4100000000000001 110.324 173.497 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.7 tt -73.36 -32.47 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-O 120.688 0.28 . . . . 1.8300000000000001 110.682 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.508 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 6.7 m-70 -58.17 -49.86 75.55 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.061 0.458 . . . . 0.45000000000000001 110.646 174.693 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 24.1 m -79.06 -11.12 59.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.854 -0.612 . . . . 1.21 111.58 -178.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.41 31.25 55.1 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.892 -0.67 . . . . 1.25 112.18 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.689 ' HB3' ' HG3' ' A' ' 80' ' ' ARG . 34.5 tt0 -74.66 105.81 5.93 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 121.157 0.503 . . . . 3.1800000000000002 109.919 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.405 ' NZ ' ' HB2' ' A' ' 86' ' ' LYS . 8.3 mtmp? . . . . . 0 C--O 1.248 1.006 0 CA-C-N 115.462 -0.79 . . . . 6.25 110.314 -176.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.43 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . . . . . . 0 N--CA 1.482 1.711 0 CA-C-O 119.347 -0.696 . . . . 1.54 111.639 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -49.71 115.08 1.62 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.608 2.205 . . . . 1.27 111.762 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.584 HD12 ' HA ' ' A' ' 72' ' ' SER . 36.4 mt -118.72 109.86 16.59 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.172 -0.922 . . . . 0.52000000000000002 110.961 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.678 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 71.5 tttt -81.2 120.69 25.2 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.132 -0.486 . . . . 1.99 110.913 -175.267 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 16.9 t -69.18 127.98 35.02 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 109.171 -0.677 . . . . 0.46000000000000002 109.171 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 36.2 ttt-85 -66.52 -47.34 73.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.956 -0.566 . . . . 3.8599999999999999 111.345 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.2 mp0 -72.37 -39.53 67.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.16 -0.473 . . . . 2.1800000000000002 111.77 -174.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.459 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 89.3 m -88.82 -40.52 13.1 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.2 0.524 . . . . 0.32000000000000001 110.651 -177.259 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 93.77 8.48 60.65 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 115.213 -0.903 . . . . 0.40000000000000002 111.381 -174.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.459 ' HG2' ' HB2' ' A' ' 65' ' ' CYS . 0.0 OUTLIER -109.41 129.76 55.53 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 122.04 0.924 . . . . 1.28 110.829 -175.727 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.678 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 58.8 mt-30 -86.62 147.78 25.76 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 113.826 -1.534 . . . . 1.77 112.218 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.569 ' CD1' HD23 ' A' ' 75' ' ' LEU . 24.8 m-85 -118.31 127.35 53.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.398 -0.819 . . . . 0.87 110.077 177.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.7 t -74.22 -18.78 60.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.812 0.339 . . . . 1.77 110.656 -178.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.8 m -101.74 127.94 48.28 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.538 -0.541 . . . . 0.90000000000000002 109.538 176.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.584 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.1 m -70.52 -44.12 68.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.73 -0.668 . . . . 1.4199999999999999 111.756 -172.335 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.519 ' O ' ' HG2' ' A' ' 77' ' ' ARG . . . -65.26 -36.73 93.15 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.567 -0.825 . . . . 0.32000000000000001 112.234 178.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -57.7 -48.8 78.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.706 0.289 . . . . 1.8100000000000001 110.407 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.569 HD23 ' CD1' ' A' ' 69' ' ' PHE . 2.2 tm? -67.31 -35.27 79.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.085 -0.507 . . . . 0.38 110.369 -179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.604 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -65.89 -45.42 82.1 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 110.234 -0.284 . . . . 1.9299999999999999 110.234 179.787 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.672 ' O ' ' HG2' ' A' ' 80' ' ' ARG . 23.7 mmt180 -62.35 -41.83 98.9 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.493 0.663 . . . . 3.9199999999999999 109.515 173.731 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -58.27 -44.82 88.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.026 -0.988 . . . . 0.48999999999999999 111.463 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.464 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 18.7 mt -79.61 -25.91 41.35 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.417 0.525 . . . . 0.51000000000000001 112.417 -176.539 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.672 ' HG2' ' O ' ' A' ' 77' ' ' ARG . 12.5 ptm180 -70.24 -18.7 63.15 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.204 -0.598 . . . . 3.4100000000000001 109.461 177.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.541 HG12 ' O ' ' A' ' 77' ' ' ARG . 41.0 mm -81.12 -32.45 12.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.124 -0.695 . . . . 1.8300000000000001 109.124 171.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.464 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 20.6 m-70 -68.83 -41.2 78.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.077 -0.965 . . . . 0.45000000000000001 111.33 178.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.3 p -82.95 -26.69 31.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.068 0.461 . . . . 1.21 111.091 178.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 93.36 8.24 61.38 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.91 -0.662 . . . . 1.25 111.854 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -81.64 92.82 6.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.155 0.502 . . . . 3.1800000000000002 110.83 -178.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.604 -0.712 . . . . 6.25 109.454 175.383 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.433 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . . . . . . 0 N--CA 1.48 1.617 0 CA-C-O 119.637 -0.535 . . . . 1.54 112.273 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.506 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 62.5 Cg_exo -35.76 116.11 0.12 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 124.259 3.306 . . . . 1.27 113.948 -178.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.519 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 83.6 mt -121.27 105.19 10.33 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.719 -1.128 . . . . 0.52000000000000002 110.557 175.185 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -82.26 127.88 33.63 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.19 -0.914 . . . . 1.99 111.481 -172.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 52.5 t -88.48 106.9 18.58 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 108.578 -0.897 . . . . 0.46000000000000002 108.578 170.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -63.01 -30.11 71.35 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.133 -0.485 . . . . 3.8599999999999999 111.648 -174.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -85.32 -26.28 26.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.301 -0.409 . . . . 2.1800000000000002 111.461 -174.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 79.8 m -99.68 -42.58 6.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.04 0.447 . . . . 0.32000000000000001 111.666 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.36 -10.04 42.52 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.269 -0.732 . . . . 0.40000000000000002 111.269 -176.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.512 ' HE3' ' CZ ' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -81.22 -178.11 6.77 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 121.088 0.47 . . . . 1.28 110.099 179.834 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.504 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 27.7 tt0 -160.34 141.22 11.99 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 115.311 -0.859 . . . . 1.77 110.378 -172.016 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.512 ' CZ ' ' HE3' ' A' ' 67' ' ' LYS . 96.1 m-85 -118.41 172.65 7.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.853 0.358 . . . . 0.87 111.425 -175.011 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.2 t -119.46 -10.53 9.65 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.549 0.69 . . . . 1.77 109.243 172.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 22.8 m -99.13 128.84 45.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.734 -0.667 . . . . 0.90000000000000002 110.031 177.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.519 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 14.0 m -70.61 -51.13 30.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.611 -0.722 . . . . 1.4199999999999999 111.419 -174.266 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.414 ' O ' ' HG3' ' A' ' 77' ' ' ARG . . . -62.33 -33.95 87.74 Favored Glycine 0 CA--C 1.51 -0.276 0 C-N-CA 120.867 -0.682 . . . . 0.32000000000000001 112.631 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -60.8 -54.48 44.64 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.908 -0.404 . . . . 1.8100000000000001 109.908 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.461 ' HG ' ' HB3' ' A' ' 60' ' ' LEU . 1.5 tm? -70.21 -32.14 69.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.842 0.353 . . . . 0.38 110.923 -177.635 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.449 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -66.64 -44.98 80.5 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.411 -0.516 . . . . 1.9299999999999999 110.6 -178.741 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.414 ' HG3' ' O ' ' A' ' 73' ' ' GLY . 24.4 mtm-85 -69.4 -33.07 72.45 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.462 0.649 . . . . 3.9199999999999999 109.823 175.023 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.402 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 56.6 t60 -58.5 -51.63 69.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.961 -1.018 . . . . 0.48999999999999999 110.465 176.436 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.565 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 32.8 mt -75.57 -18.92 59.61 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.177 -0.465 . . . . 0.51000000000000001 111.109 178.746 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.496 ' HA ' ' HG2' ' A' ' 85' ' ' GLU . 49.8 ttp180 -58.01 -48.29 80.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.308 -0.405 . . . . 3.4100000000000001 109.966 177.405 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 38.5 pt -77.22 -25.4 15.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 1.8300000000000001 110.981 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.565 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 21.9 m-70 -65.44 -47.31 76.61 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.831 0.348 . . . . 0.45000000000000001 111.195 176.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.2 m -89.6 -23.82 21.85 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.233 -0.44 . . . . 1.21 111.405 -177.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 81.98 26.13 50.15 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.886 -0.673 . . . . 1.25 111.931 -178.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.496 ' HG2' ' HA ' ' A' ' 80' ' ' ARG . 7.6 pt-20 -74.57 115.61 14.32 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.274 0.559 . . . . 3.1800000000000002 111.697 -174.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 60.5 mttp . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.54 -0.743 . . . . 6.25 109.546 172.188 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.666 0 CA-C-O 119.761 -0.466 . . . . 1.54 112.232 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.701 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 9.6 Cg_endo -50.79 116.04 2.36 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 123.001 2.467 . . . . 1.27 112.594 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 87.9 mt -132.01 120.79 22.91 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.862 -1.063 . . . . 0.52000000000000002 111.144 176.461 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.651 ' HD2' ' HB3' ' A' ' 68' ' ' GLN . 2.5 mptm? -80.39 129.95 34.85 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.324 -0.398 . . . . 1.99 111.053 -176.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 37.1 t -75.33 114.55 13.99 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.711 -0.848 . . . . 0.46000000000000002 108.711 170.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 63' ' ' ARG . 23.7 ttt180 -53.73 -46.13 70.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.402 -0.817 . . . . 3.8599999999999999 112.119 -176.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 30.1 mp0 -75.87 -31.36 59.23 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.106 -0.497 . . . . 2.1800000000000002 112.009 -174.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 91.6 m -98.27 -40.47 8.33 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.231 0.456 . . . . 0.32000000000000001 112.231 -174.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 100.43 -0.92 55.75 Favored Glycine 0 N--CA 1.455 -0.098 0 C-N-CA 120.874 -0.679 . . . . 0.40000000000000002 111.824 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -93.1 -175.7 3.94 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 109.303 -0.629 . . . . 1.28 109.303 179.171 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.651 ' HB3' ' HD2' ' A' ' 61' ' ' LYS . 20.6 pt20 -141.38 150.21 42.11 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.001 0.429 . . . . 1.77 111.703 -171.203 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.701 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 58.6 m-85 -118.94 177.42 4.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.827 -0.624 . . . . 0.87 109.825 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.4 p -120.26 0.35 10.61 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.171 0.51 . . . . 1.77 111.146 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.652 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 8.3 m -126.71 130.02 49.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.876 -0.602 . . . . 0.90000000000000002 110.163 -175.314 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.419 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 49.6 m -63.23 -51.25 67.0 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.597 -0.729 . . . . 1.4199999999999999 111.646 -177.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.4 -28.6 73.16 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.854 -0.689 . . . . 0.32000000000000001 111.873 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.652 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 41.3 t-20 -64.58 -50.67 66.33 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.705 -0.48 . . . . 1.8100000000000001 109.705 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.556 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.3 tm? -65.78 -38.87 90.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.31 -0.405 . . . . 0.38 110.377 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.8 mmmt -66.04 -47.9 72.86 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.831 -0.348 . . . . 1.9299999999999999 111.18 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.412 ' O ' HG13 ' A' ' 81' ' ' ILE . 42.8 ttm180 -60.06 -41.57 92.65 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.234 0.54 . . . . 3.9199999999999999 109.829 175.751 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -59.97 -45.03 94.02 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.135 -0.939 . . . . 0.48999999999999999 111.273 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.617 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 34.1 mt -78.04 -19.54 54.13 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.666 -0.414 . . . . 0.51000000000000001 110.952 -176.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -69.58 -33.08 72.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.03 -0.73 . . . . 3.4100000000000001 109.03 172.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 77' ' ' ARG . 70.7 mt -75.67 -32.06 23.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.392 -0.822 . . . . 1.8300000000000001 110.024 174.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.617 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 6.1 m-70 -65.53 -37.54 87.03 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.166 -0.47 . . . . 0.45000000000000001 111.375 176.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 51.8 p -83.77 -28.44 28.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.085 0.469 . . . . 1.21 110.68 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 92.77 15.97 50.4 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.842 -0.694 . . . . 1.25 112.141 177.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -80.36 123.4 27.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.056 0.455 . . . . 3.1800000000000002 110.496 -178.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 49.9 tttp . . . . . 0 C--O 1.246 0.902 0 CA-C-N 115.393 -0.821 . . . . 6.25 110.265 -179.306 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.597 0 CA-C-O 119.593 -0.559 . . . . 1.54 112.082 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_exo -38.75 117.73 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 124.035 3.157 . . . . 1.27 114.635 -177.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.471 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 95.8 mt -121.0 92.59 3.79 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.116 -1.402 . . . . 0.52000000000000002 108.299 171.151 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.762 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 51.8 tttp -80.63 126.23 31.0 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.462 0.649 . . . . 1.99 112.501 -162.206 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 51.2 t -82.32 105.58 13.51 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 115.141 -0.936 . . . . 0.46000000000000002 108.514 174.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -62.91 -29.31 70.68 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.776 0.322 . . . . 3.8599999999999999 111.198 -176.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -79.4 -30.86 42.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.91 0.337 . . . . 2.1800000000000002 111.91 -176.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 67.0 m -94.91 -41.94 8.93 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.461 0.648 . . . . 0.32000000000000001 110.679 176.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.05 -12.1 34.26 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.092 -0.958 . . . . 0.40000000000000002 111.437 -177.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.573 ' HD2' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -110.83 128.78 55.9 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 122.399 1.095 . . . . 1.28 111.451 -177.048 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.762 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -78.73 164.34 24.65 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 113.333 -1.758 . . . . 1.77 112.75 174.781 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -122.25 143.71 49.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.973 -1.012 . . . . 0.87 110.356 176.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.0 t -91.65 7.03 43.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.075 0.464 . . . . 1.77 110.735 177.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.452 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 3.9 m -126.22 129.57 49.23 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.735 -0.468 . . . . 0.90000000000000002 109.735 179.225 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.471 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 22.8 t -69.51 -50.76 42.13 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.621 -0.718 . . . . 1.4199999999999999 111.733 -172.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.2 -34.94 90.74 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.51 -0.852 . . . . 0.32000000000000001 111.833 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.452 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 4.7 m-20 -62.11 -50.75 70.67 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.576 -0.157 . . . . 1.8100000000000001 110.576 178.077 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.453 HD22 ' O ' ' A' ' 75' ' ' LEU . 0.6 OUTLIER -68.97 -37.01 78.54 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 123.162 0.288 . . . . 0.38 110.796 -177.489 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.556 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -62.44 -52.26 64.24 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.67 -0.412 . . . . 1.9299999999999999 110.47 178.272 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 77' ' ' ARG . 27.9 mtp180 -62.94 -30.4 71.53 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.427 0.632 . . . . 3.9199999999999999 110.414 176.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.444 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 69.8 t60 -66.32 -50.81 62.35 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.946 -1.024 . . . . 0.48999999999999999 110.695 178.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.557 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 42.8 mt -75.92 -19.73 58.55 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.769 0.319 . . . . 0.51000000000000001 110.807 179.016 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -58.93 -49.58 77.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.96 -0.564 . . . . 3.4100000000000001 109.798 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.0 tp -73.78 -30.38 28.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.037 -0.529 . . . . 1.8300000000000001 110.47 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.557 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 22.9 m-70 -61.84 -46.44 89.44 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.698 0.285 . . . . 0.45000000000000001 111.109 176.529 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.3 m -80.73 -13.91 58.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.027 -0.533 . . . . 1.21 111.252 -176.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.69 29.38 57.74 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.987 -0.625 . . . . 1.25 112.17 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -104.32 152.4 22.29 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 121.16 0.505 . . . . 3.1800000000000002 109.774 -177.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt . . . . . 0 C--N 1.31 -1.135 0 CA-C-N 115.335 -0.848 . . . . 6.25 110.442 -179.171 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.583 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . . . . . . 0 N--CA 1.483 1.781 0 CA-C-O 119.31 -0.717 . . . . 1.54 111.948 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.474 ' HB3' ' OE1' ' A' ' 68' ' ' GLN . 59.5 Cg_exo -40.36 115.83 0.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 123.003 2.469 . . . . 1.27 112.825 176.67 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 58' ' ' GLY . 96.6 mt -113.67 110.72 20.66 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.497 -0.774 . . . . 0.52000000000000002 111.167 -179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 45.5 tptt -81.92 114.03 20.24 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.325 -0.852 . . . . 1.99 109.89 -176.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 41.8 t -70.75 109.53 5.01 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.43 -0.582 . . . . 0.46000000000000002 109.43 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -58.41 -27.3 64.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.802 -0.636 . . . . 3.8599999999999999 111.483 -177.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -93.43 -20.05 20.69 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.747 0.647 . . . . 2.1800000000000002 112.747 -175.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.446 ' HB3' ' HG3' ' A' ' 67' ' ' LYS . 64.4 m -105.87 -41.37 5.43 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.211 0.448 . . . . 0.32000000000000001 112.211 178.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.91 -0.08 59.02 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.44 -0.886 . . . . 0.40000000000000002 111.565 -175.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.446 ' HG3' ' HB3' ' A' ' 65' ' ' CYS . 0.0 OUTLIER -108.09 -178.36 3.59 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 109.182 -0.673 . . . . 1.28 109.182 176.104 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.56 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 35.1 tt0 -141.68 148.92 39.88 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 111.763 0.283 . . . . 1.77 111.763 -159.322 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.468 ' CD1' HD23 ' A' ' 75' ' ' LEU . 66.5 m-85 -126.19 140.52 52.49 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 120.815 0.341 . . . . 0.87 111.229 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.2 p -84.72 -22.25 29.8 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.281 -0.418 . . . . 1.77 111.406 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 4.6 m -104.72 129.9 52.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.853 -0.612 . . . . 0.90000000000000002 110.411 -177.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.419 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 14.6 m -60.59 -47.87 84.28 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.343 -0.844 . . . . 1.4199999999999999 111.857 -176.378 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.25 -32.97 85.95 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.934 -0.65 . . . . 0.32000000000000001 112.431 -179.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.441 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 5.4 m-20 -62.24 -46.36 89.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.537 0.208 . . . . 1.8100000000000001 110.873 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.468 HD23 ' CD1' ' A' ' 69' ' ' PHE . 2.1 tm? -77.18 -31.8 55.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.545 -0.298 . . . . 0.38 110.592 -177.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.515 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -67.21 -44.95 78.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.659 0.266 . . . . 1.9299999999999999 110.955 177.817 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.463 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 70.7 ttt180 -66.07 -34.61 78.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.579 0.704 . . . . 3.9199999999999999 109.771 174.328 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.475 ' O ' HG22 ' A' ' 81' ' ' ILE . 77.6 t60 -65.83 -46.28 79.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.976 -1.011 . . . . 0.48999999999999999 110.689 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.532 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 31.3 mt -74.27 -19.44 60.49 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.674 0.274 . . . . 0.51000000000000001 110.803 177.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.463 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 70.4 ttt180 -60.32 -47.74 84.75 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.282 -0.417 . . . . 3.4100000000000001 109.955 176.587 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.475 HG22 ' O ' ' A' ' 78' ' ' HIS . 11.3 tp -72.88 -25.83 22.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.303 -0.408 . . . . 1.8300000000000001 110.36 177.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.532 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 32.3 m-70 -67.63 -41.44 83.91 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.048 0.452 . . . . 0.45000000000000001 110.683 175.229 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.0 m -76.6 -24.26 53.45 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.138 0.494 . . . . 1.21 110.352 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 90.75 18.76 46.6 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.967 -0.635 . . . . 1.25 112.156 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -84.21 123.17 29.82 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.134 0.492 . . . . 3.1800000000000002 110.5 -176.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp . . . . . 0 C--O 1.25 1.104 0 CA-C-N 115.404 -0.816 . . . . 6.25 110.433 -179.198 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.688 0 CA-C-O 119.817 -0.435 . . . . 1.54 112.116 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -56.29 115.87 2.78 Favored 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 122.511 2.141 . . . . 1.27 112.65 -176.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.588 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 67.0 mt -107.92 134.51 50.74 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.348 -0.842 . . . . 0.52000000000000002 110.676 176.161 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.502 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 11.4 tppt? -80.85 128.31 33.53 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.091 -0.504 . . . . 1.99 112.188 -171.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 41.2 t -90.9 99.29 12.35 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.577 -1.268 . . . . 0.46000000000000002 107.577 166.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -63.78 -24.82 67.92 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 111.893 0.331 . . . . 3.8599999999999999 111.893 -173.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -76.46 -30.61 57.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.677 -0.238 . . . . 2.1800000000000002 111.489 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 67.6 m -97.5 -41.54 8.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.161 0.505 . . . . 0.32000000000000001 111.141 178.19 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.55 6.5 50.19 Favored Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 110.827 -0.909 . . . . 0.40000000000000002 110.827 -178.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.463 ' HE3' ' HE1' ' A' ' 69' ' ' PHE . 25.1 pttt -108.07 -177.57 3.37 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 108.972 -0.751 . . . . 1.28 108.972 -177.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.588 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 50.1 mt-30 -137.31 163.44 30.98 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 116.03 -0.532 . . . . 1.77 110.593 -174.298 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.542 ' CD1' HD23 ' A' ' 75' ' ' LEU . 14.1 m-85 -132.73 131.33 41.08 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-O 121.121 0.486 . . . . 0.87 110.885 -177.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.7 m -67.68 -26.69 66.32 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 114.799 -1.092 . . . . 1.77 112.529 -174.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.4 m -114.28 130.0 56.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.108 0.48 . . . . 0.90000000000000002 110.255 -178.166 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.533 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.2 m -56.4 -45.53 80.59 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 114.997 -1.001 . . . . 1.4199999999999999 111.825 -176.528 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.87 -34.51 90.12 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.634 -0.793 . . . . 0.32000000000000001 112.086 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 4.1 m-20 -63.05 -44.96 94.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.212 0.054 . . . . 1.8100000000000001 110.882 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.542 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.4 tm? -72.03 -38.39 69.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.847 0.356 . . . . 0.38 110.176 -178.518 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.594 ' O ' ' HG3' ' A' ' 80' ' ' ARG . 0.1 OUTLIER -62.53 -50.7 70.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.326 -0.397 . . . . 1.9299999999999999 110.016 178.874 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -59.14 -40.97 87.17 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.627 0.727 . . . . 3.9199999999999999 110.354 175.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.436 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 77.2 t60 -58.04 -42.82 86.2 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.527 -1.215 . . . . 0.48999999999999999 111.119 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.473 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 53.7 mt -79.66 -19.17 49.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.174 -0.466 . . . . 0.51000000000000001 111.836 -177.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.594 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 25.4 mtp180 -62.75 -41.76 99.36 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.978 -0.749 . . . . 3.4100000000000001 108.978 173.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 73.0 mt -65.61 -40.19 87.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.049 -0.978 . . . . 1.8300000000000001 110.446 176.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.473 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 31.5 m-70 -65.65 -31.89 73.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.896 -0.593 . . . . 0.45000000000000001 111.858 178.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.5 m -83.93 -58.52 2.75 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.717 0.294 . . . . 1.21 111.069 -178.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.544 ' O ' ' HE2' ' A' ' 86' ' ' LYS . . . 139.7 -40.06 1.45 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.714 -0.755 . . . . 1.25 111.738 -178.34 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -74.16 98.57 3.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.113 0.482 . . . . 3.1800000000000002 110.445 176.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.544 ' HE2' ' O ' ' A' ' 84' ' ' GLY . 26.0 mtmt . . . . . 0 C--O 1.249 1.056 0 CA-C-N 115.46 -0.791 . . . . 6.25 109.741 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.458 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . . . . . . 0 N--CA 1.481 1.687 0 CA-C-O 119.617 -0.546 . . . . 1.54 111.989 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.787 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 8.1 Cg_endo -49.61 116.12 2.17 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.052 2.501 . . . . 1.27 112.53 -178.663 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.668 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 61.1 mt -127.21 107.57 10.13 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.91 -1.041 . . . . 0.52000000000000002 111.076 179.696 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.669 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 15.7 ttpt -82.32 134.2 35.26 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.261 0.553 . . . . 1.99 111.033 -175.815 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 49.4 t -87.27 96.57 10.39 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 108.166 -1.05 . . . . 0.46000000000000002 108.166 173.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -50.77 -37.71 43.82 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.528 0.517 . . . . 3.8599999999999999 110.877 179.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.6 mp0 -65.06 -38.77 91.88 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.426 -0.806 . . . . 2.1800000000000002 112.089 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.475 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 62.7 m -97.16 -41.16 8.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.124 0.488 . . . . 0.32000000000000001 111.544 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 105.63 0.12 39.78 Favored Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 111.087 -0.805 . . . . 0.40000000000000002 111.087 -177.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.574 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 14.8 ptmt -95.9 -178.39 4.34 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 115.064 -0.568 . . . . 1.28 109.905 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.669 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 26.6 tt0 -149.04 143.69 26.24 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 116.12 -0.491 . . . . 1.77 110.728 -174.382 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.787 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 53.9 m-85 -113.61 -173.99 2.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.977 -0.556 . . . . 0.87 109.803 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.5 t -134.87 18.86 3.5 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.44 0.638 . . . . 1.77 110.075 175.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 88.6 m -137.89 128.65 26.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.90000000000000002 110.01 -178.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.668 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 5.3 p -64.14 -59.71 4.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.142 -0.935 . . . . 1.4199999999999999 112.356 -175.497 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.18 -34.87 81.8 Favored Glycine 0 C--O 1.229 -0.177 0 C-N-CA 121.003 -0.618 . . . . 0.32000000000000001 112.819 -177.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -65.08 -48.07 75.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.624 -0.139 . . . . 1.8100000000000001 110.624 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.552 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.5 tm? -70.09 -37.78 75.5 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.564 -0.289 . . . . 0.38 110.446 -178.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.665 ' O ' ' HG2' ' A' ' 80' ' ' ARG . 7.8 mmpt? -61.19 -49.64 76.36 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.115 -0.328 . . . . 1.9299999999999999 110.115 177.138 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -60.34 -40.72 91.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.453 0.644 . . . . 3.9199999999999999 110.264 175.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.423 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 74.4 t60 -56.04 -44.97 79.31 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.003 -0.998 . . . . 0.48999999999999999 110.732 177.307 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.564 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 45.9 mt -80.17 -18.65 49.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.245 -0.434 . . . . 0.51000000000000001 111.637 -178.482 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.665 ' HG2' ' O ' ' A' ' 76' ' ' LYS . 4.5 mmp_? -60.83 -45.49 94.27 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.91 -0.774 . . . . 3.4100000000000001 108.91 171.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 66.8 mt -60.15 -41.3 86.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.154 -0.93 . . . . 1.8300000000000001 109.963 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.564 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 39.6 m-70 -65.97 -15.19 62.78 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.879 -0.601 . . . . 0.45000000000000001 111.632 177.642 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 33.8 t -101.8 -0.19 34.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.827 0.346 . . . . 1.21 110.764 179.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.1 26.31 64.52 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.898 -0.667 . . . . 1.25 112.673 179.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -73.9 96.1 2.56 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.152 0.501 . . . . 3.1800000000000002 110.48 178.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 55.0 tttp . . . . . 0 C--O 1.245 0.838 0 CA-C-N 115.272 -0.877 . . . . 6.25 109.717 -179.818 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.427 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . . . . . . 0 N--CA 1.482 1.748 0 CA-C-O 119.414 -0.659 . . . . 1.54 112.166 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.556 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 83.3 Cg_exo -45.48 116.59 1.38 Allowed 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.862 2.375 . . . . 1.27 112.654 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.953 ' HB3' HD12 ' A' ' 75' ' ' LEU . 75.6 mt -132.24 163.83 27.74 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.101 -0.954 . . . . 0.52000000000000002 109.876 178.466 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 10.5 tptm -127.12 127.0 43.9 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 120.897 0.379 . . . . 1.99 110.318 -178.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.731 ' SG ' ' CD2' ' A' ' 78' ' ' HIS . 0.5 OUTLIER -100.08 79.62 2.2 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 108.395 -0.965 . . . . 0.46000000000000002 108.395 -176.214 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -51.1 -36.47 40.56 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 113.176 0.806 . . . . 3.8599999999999999 113.176 -169.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.721 ' CD ' ' H ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER -65.98 -35.74 81.41 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.984 0.421 . . . . 2.1800000000000002 110.33 178.614 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.401 ' HB2' ' HB3' ' A' ' 62' ' ' CYS . 72.5 m -92.59 -40.61 10.68 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.9 -0.591 . . . . 0.32000000000000001 110.659 -176.041 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.9 11.48 49.77 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.718 -0.953 . . . . 0.40000000000000002 110.718 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.517 ' HE3' ' CE1' ' A' ' 69' ' ' PHE . 46.0 pttt -108.0 -176.53 3.08 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 114.913 -0.644 . . . . 1.28 109.661 -177.041 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -138.36 156.45 47.59 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 115.514 -0.766 . . . . 1.77 109.707 -175.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.723 ' CD1' ' HG ' ' A' ' 75' ' ' LEU . 41.8 m-85 -123.4 164.33 19.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.983 0.42 . . . . 0.87 110.683 178.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.2 t -121.21 9.89 10.54 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.47 -0.937 . . . . 1.77 108.47 173.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.471 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 32.0 m -137.74 127.82 25.9 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.739 -1.119 . . . . 0.90000000000000002 109.956 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.413 ' HA ' HD11 ' A' ' 60' ' ' LEU . 19.9 t -71.18 -43.47 67.37 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.81 -0.632 . . . . 1.4199999999999999 110.816 -177.725 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.2 -28.8 73.46 Favored Glycine 0 C--N 1.331 0.291 0 C-N-CA 120.907 -0.664 . . . . 0.32000000000000001 112.678 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.471 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 34.3 m-20 -68.84 -51.57 39.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.456 0.17 . . . . 1.8100000000000001 110.676 177.733 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.953 HD12 ' HB3' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -67.46 -37.58 83.17 Favored 'General case' 0 C--O 1.223 -0.323 0 N-CA-C 109.753 -0.462 . . . . 0.38 109.753 179.508 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.569 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -54.73 -52.64 61.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.91 0.386 . . . . 1.9299999999999999 110.765 177.417 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -63.09 -40.53 97.92 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.321 0.581 . . . . 3.9199999999999999 110.888 179.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.731 ' CD2' ' SG ' ' A' ' 62' ' ' CYS . 78.0 t60 -69.5 -28.68 66.27 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.527 -0.761 . . . . 0.48999999999999999 111.063 -178.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.674 ' HG ' HD22 ' A' ' 75' ' ' LEU . 79.7 mt -74.52 -28.24 60.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.92 0.391 . . . . 0.51000000000000001 110.768 173.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -62.27 -42.26 99.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.018 -0.537 . . . . 3.4100000000000001 109.928 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.9 tt -76.31 -24.7 16.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 116.27 -0.423 . . . . 1.8300000000000001 110.725 176.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.559 ' NE2' ' NE2' ' A' ' 78' ' ' HIS . 11.6 m-70 -66.69 -36.51 82.67 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.795 0.331 . . . . 0.45000000000000001 110.599 174.482 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.6 m -85.49 -25.81 26.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.043 0.449 . . . . 1.21 111.085 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 73.67 29.05 64.07 Favored Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.64 -0.709 . . . . 1.25 112.595 176.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -122.1 173.03 7.82 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.93 0.395 . . . . 3.1800000000000002 110.71 -176.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? . . . . . 0 C--O 1.249 1.043 0 CA-C-N 115.505 -0.77 . . . . 6.25 110.364 177.854 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.598 0 N-CA-C 111.894 -0.482 . . . . 1.54 111.894 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.428 ' HB3' ' OE1' ' A' ' 68' ' ' GLN . 48.2 Cg_exo -57.63 115.02 2.22 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.507 2.138 . . . . 1.27 112.878 -173.052 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.534 HD12 ' HA ' ' A' ' 72' ' ' SER . 80.4 mt -109.31 116.35 31.7 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 114.943 -1.026 . . . . 0.52000000000000002 110.195 176.356 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 2.4 mppt? -82.28 133.93 35.26 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.568 0.699 . . . . 1.99 111.663 -174.064 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.436 ' SG ' ' HB2' ' A' ' 64' ' ' GLU . 44.8 t -78.05 97.26 5.33 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 114.782 -1.099 . . . . 0.46000000000000002 108.087 170.691 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -56.22 -22.74 31.26 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.201 0.524 . . . . 3.8599999999999999 111.132 -177.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.436 ' HB2' ' SG ' ' A' ' 62' ' ' CYS . 16.3 mm-40 -72.44 -37.37 68.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.917 -0.583 . . . . 2.1800000000000002 111.339 177.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.459 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 89.4 m -107.77 -41.45 5.0 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.594 0.59 . . . . 0.32000000000000001 112.594 -173.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.89 -6.46 32.88 Favored Glycine 0 N--CA 1.452 -0.246 0 N-CA-C 111.416 -0.674 . . . . 0.40000000000000002 111.416 -176.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.497 ' O ' ' HA ' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -85.67 -178.17 6.57 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 122.982 0.513 . . . . 1.28 109.655 178.961 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.52 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 11.2 pt20 -145.35 153.84 41.67 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 116.015 -0.539 . . . . 1.77 111.37 -172.254 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.512 ' CD1' HD23 ' A' ' 75' ' ' LEU . 56.9 m-85 -135.8 121.93 20.22 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.288 -0.415 . . . . 0.87 109.93 176.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.7 t -71.92 -10.81 60.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.113 0.483 . . . . 1.77 111.083 -177.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 18.7 m -110.76 129.85 55.73 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.985 -0.552 . . . . 0.90000000000000002 110.218 178.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.534 ' HA ' HD12 ' A' ' 60' ' ' LEU . 49.2 m -65.81 -41.9 91.31 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.441 -0.8 . . . . 1.4199999999999999 112.306 -173.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.04 -36.02 92.73 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.057 -0.592 . . . . 0.32000000000000001 112.583 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -62.99 -50.24 71.51 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.401 -0.222 . . . . 1.8100000000000001 110.401 178.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.512 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.1 tm? -68.19 -33.47 74.49 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.389 -0.369 . . . . 0.38 110.304 -178.035 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.557 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -65.46 -51.25 61.49 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.654 0.264 . . . . 1.9299999999999999 110.459 178.045 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.479 ' HD3' ' O ' ' A' ' 77' ' ' ARG . 3.6 tmt_? -64.26 -34.49 78.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.313 0.578 . . . . 3.9199999999999999 109.445 176.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -60.37 -51.92 67.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.452 -0.794 . . . . 0.48999999999999999 110.94 177.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.476 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 31.3 mt -75.28 -19.66 59.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.384 -0.371 . . . . 0.51000000000000001 111.315 -179.066 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.513 ' HG3' ' HG3' ' A' ' 85' ' ' GLU . 42.7 ttm180 -55.99 -54.89 39.35 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.445 -0.576 . . . . 3.4100000000000001 109.445 171.746 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 45.9 mm -57.74 -40.29 74.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.68 -0.691 . . . . 1.8300000000000001 109.956 178.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.476 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 45.4 m-70 -64.01 -28.01 69.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.562 -0.744 . . . . 0.45000000000000001 112.091 178.575 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.1 m -87.18 2.0 51.33 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.674 0.273 . . . . 1.21 111.455 -176.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 89.16 14.34 60.63 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.419 -0.896 . . . . 1.25 112.696 177.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.513 ' HG3' ' HG3' ' A' ' 80' ' ' ARG . 7.1 pt-20 -116.95 140.6 49.27 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.16 -0.681 . . . . 3.1800000000000002 109.16 176.621 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm . . . . . 0 C--N 1.314 -0.949 0 CA-C-O 118.725 -0.655 . . . . 6.25 111.414 -171.717 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.699 0 N-CA-C 111.895 -0.482 . . . . 1.54 111.895 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.46 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 89.5 Cg_exo -44.4 116.94 1.2 Allowed 'Trans proline' 0 C--O 1.235 0.367 0 C-N-CA 123.497 2.798 . . . . 1.27 113.59 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.564 HD12 ' HA ' ' A' ' 72' ' ' SER . 91.6 mt -126.11 124.64 41.02 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.127 -0.942 . . . . 0.52000000000000002 110.782 175.576 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.1 tppt? -82.91 140.18 32.98 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.819 -0.628 . . . . 1.99 111.526 -174.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 45.7 t -96.86 95.38 7.82 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 107.746 -1.205 . . . . 0.46000000000000002 107.746 164.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.3 ttp180 -52.17 -36.3 51.33 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 123.398 0.436 . . . . 3.8599999999999999 111.748 -177.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -71.62 -35.13 70.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.1 -0.5 . . . . 2.1800000000000002 111.355 -175.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.441 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 65.3 m -94.02 -41.48 9.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.168 0.509 . . . . 0.32000000000000001 111.364 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 103.71 6.03 44.17 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 111.205 -0.758 . . . . 0.40000000000000002 111.205 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.558 ' HE2' ' CZ ' ' A' ' 69' ' ' PHE . 11.5 ptmt -101.41 -177.31 3.4 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.101 -0.549 . . . . 1.28 109.912 -178.286 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.43 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 35.6 tt0 -150.86 142.23 23.37 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.748 -0.66 . . . . 1.77 110.078 -168.716 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.638 ' CD1' HD23 ' A' ' 75' ' ' LEU . 88.1 m-85 -123.6 150.64 43.87 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-O 120.824 0.345 . . . . 0.87 111.09 -174.068 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.4 p -90.91 -25.26 19.9 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.164 -0.471 . . . . 1.77 111.69 -177.247 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.486 HG23 ' CB ' ' A' ' 74' ' ' ASN . 0.5 OUTLIER -108.72 132.7 53.69 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.588 0.709 . . . . 0.90000000000000002 110.648 -179.825 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.564 ' HA ' HD12 ' A' ' 60' ' ' LEU . 66.2 m -64.57 -43.8 92.73 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 114.763 -1.108 . . . . 1.4199999999999999 111.787 -174.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.62 -33.47 86.74 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.574 -0.822 . . . . 0.32000000000000001 112.326 -177.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.503 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 62.0 t30 -69.29 -40.56 77.64 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.096 -0.242 . . . . 1.8100000000000001 110.371 -179.227 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.638 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.6 tm? -76.47 -34.68 58.68 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.586 0.231 . . . . 0.38 110.552 -179.054 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.571 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 8.8 mmpt? -64.85 -46.58 81.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.652 0.263 . . . . 1.9299999999999999 110.35 177.343 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -60.95 -41.72 96.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.694 0.759 . . . . 3.9199999999999999 109.736 174.093 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.503 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 61.3 t60 -58.51 -46.88 85.81 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.292 -1.322 . . . . 0.48999999999999999 111.23 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.563 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 28.8 mt -83.81 -18.86 36.24 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 111.919 0.34 . . . . 0.51000000000000001 111.919 -176.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -61.86 -48.18 81.67 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.803 -0.443 . . . . 3.4100000000000001 109.803 174.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 13.9 tt -70.14 -29.46 39.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.3 -0.409 . . . . 1.8300000000000001 110.481 178.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.563 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 18.3 m-70 -63.65 -29.54 70.76 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.008 0.432 . . . . 0.45000000000000001 110.29 173.172 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 47.5 m -85.81 3.2 42.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.986 -0.552 . . . . 1.21 111.126 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 91.75 -6.11 79.71 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.758 -0.734 . . . . 1.25 112.662 177.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -83.42 110.55 18.25 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.738 0.304 . . . . 3.1800000000000002 110.413 -178.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt . . . . . 0 C--O 1.245 0.859 0 CA-C-O 118.64 -0.695 . . . . 6.25 110.124 179.219 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.721 0 CA-C-O 119.582 -0.565 . . . . 1.54 111.772 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.578 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 27.5 Cg_endo -62.55 115.85 3.16 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 121.651 1.567 . . . . 1.27 111.028 178.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.695 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 67.9 mt -97.57 129.76 44.67 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.268 -0.878 . . . . 0.52000000000000002 111.809 -175.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 40.8 tptt -81.4 126.14 31.26 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.214 -0.903 . . . . 1.99 111.151 -172.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 28.8 t -80.39 117.29 21.01 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.721 -0.844 . . . . 0.46000000000000002 108.721 171.337 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -60.23 -34.97 74.42 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.661 0.615 . . . . 3.8599999999999999 112.661 -172.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -94.1 -21.59 19.02 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.64 -0.424 . . . . 2.1800000000000002 111.943 -172.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.417 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 84.3 m -99.35 -41.07 7.59 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.648 -0.421 . . . . 0.32000000000000001 111.961 -179.66 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.58 2.52 58.69 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.707 -0.758 . . . . 0.40000000000000002 111.517 -177.447 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.677 ' HE3' ' CE1' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -90.7 -176.72 4.8 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 109.764 -0.458 . . . . 1.28 109.764 178.429 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.695 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 28.2 pt20 -150.0 148.35 28.95 Favored 'General case' 0 C--N 1.309 -1.196 0 CA-C-N 115.898 -0.592 . . . . 1.77 111.114 -173.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.677 ' CE1' ' HE3' ' A' ' 67' ' ' LYS . 32.1 m-85 -122.44 133.29 54.62 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.315 -0.402 . . . . 0.87 111.51 -176.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.4 t -74.14 -16.28 61.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.329 0.585 . . . . 1.77 110.32 177.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.53 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 13.1 m -109.91 128.95 55.68 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.047 -0.524 . . . . 0.90000000000000002 110.136 177.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.558 ' HA ' HD12 ' A' ' 60' ' ' LEU . 42.5 t -69.16 -40.76 77.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.513 -0.767 . . . . 1.4199999999999999 110.901 -176.288 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.36 -38.49 95.03 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.656 -0.783 . . . . 0.32000000000000001 111.983 178.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.53 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 39.9 m-20 -61.05 -43.08 99.43 Favored 'General case' 0 C--O 1.221 -0.435 0 C-N-CA 121.434 -0.106 . . . . 1.8100000000000001 110.927 178.505 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.523 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.6 tm? -69.79 -37.37 76.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.816 0.341 . . . . 0.38 110.267 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.544 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -66.96 -45.5 77.57 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.841 -0.344 . . . . 1.9299999999999999 110.11 179.734 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.57 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 4.9 tmt_? -64.99 -33.91 77.18 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.441 0.639 . . . . 3.9199999999999999 109.817 175.05 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.433 ' O ' HG22 ' A' ' 81' ' ' ILE . 73.6 t60 -63.92 -43.77 94.92 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.307 -0.861 . . . . 0.48999999999999999 110.616 177.207 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.602 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 44.1 mt -80.05 -18.59 49.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.942 0.401 . . . . 0.51000000000000001 110.635 178.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.57 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 28.7 tpt180 -56.31 -47.61 78.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.021 -0.536 . . . . 3.4100000000000001 109.936 172.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.433 HG22 ' O ' ' A' ' 78' ' ' HIS . 9.0 tp -74.7 -27.35 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 120.647 -0.421 . . . . 1.8300000000000001 110.606 178.452 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.602 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 28.5 m-70 -65.63 -26.03 67.64 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.087 0.47 . . . . 0.45000000000000001 110.955 174.153 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 56.7 m -74.78 -22.08 58.96 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.981 -0.554 . . . . 1.21 110.523 176.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.91 -3.04 72.03 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 121.021 -0.609 . . . . 1.25 112.802 177.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -68.15 119.38 12.64 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 121.096 0.474 . . . . 3.1800000000000002 110.87 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.246 0.915 0 CA-C-N 115.349 -0.841 . . . . 6.25 109.751 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.886 0 CA-C-O 119.785 -0.453 . . . . 1.54 112.098 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.48 ' CB ' ' HB3' ' A' ' 68' ' ' GLN . 70.6 Cg_exo -52.61 115.99 2.58 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.451 2.101 . . . . 1.27 112.244 -179.242 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.681 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 99.5 mt -86.1 128.96 34.97 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.058 -0.974 . . . . 0.52000000000000002 110.62 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 67' ' ' LYS . 5.5 tppp? -81.8 129.75 34.84 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.246 -0.434 . . . . 1.99 111.627 -172.361 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 19.5 t -82.5 128.77 34.6 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 108.688 -0.856 . . . . 0.46000000000000002 108.688 169.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.511 ' HA ' ' NE ' ' A' ' 63' ' ' ARG . 1.2 mmp_? -71.14 -38.88 72.23 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.109 -0.496 . . . . 3.8599999999999999 111.973 -172.217 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -90.46 -12.27 37.86 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.164 0.431 . . . . 2.1800000000000002 112.164 -174.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.482 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 99.1 m -109.67 -41.72 4.48 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.652 -0.419 . . . . 0.32000000000000001 111.703 178.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 96.19 1.3 61.12 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.513 -0.851 . . . . 0.40000000000000002 111.698 -177.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.501 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 17.9 ptmt -88.28 -177.72 5.74 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 122.816 0.446 . . . . 1.28 110.126 179.597 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.681 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 49.2 mt-30 -145.14 144.11 30.72 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.733 -0.667 . . . . 1.77 111.405 -170.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.552 ' CD1' HD23 ' A' ' 75' ' ' LEU . 50.4 m-85 -123.1 135.92 54.58 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.162 -0.472 . . . . 0.87 111.454 -178.855 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.6 p -83.67 -4.52 58.67 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.256 -0.429 . . . . 1.77 111.448 -178.532 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.488 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 28.5 m -123.76 129.64 51.38 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.981 -0.554 . . . . 0.90000000000000002 109.924 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.1 t -61.11 -52.89 62.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.416 -0.811 . . . . 1.4199999999999999 111.579 -175.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.95 -29.22 71.89 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.883 -0.675 . . . . 0.32000000000000001 112.424 179.635 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.488 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 5.0 m-20 -66.39 -37.74 85.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.565 0.221 . . . . 1.8100000000000001 110.672 178.72 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.552 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.8 tm? -81.06 -32.01 34.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.373 -0.376 . . . . 0.38 110.299 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.564 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -67.39 -47.0 71.61 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.754 0.279 . . . . 1.9299999999999999 111.754 179.148 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -31.74 73.09 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.9 0.857 . . . . 3.9199999999999999 109.092 176.74 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.422 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 72.7 t60 -65.29 -52.09 56.49 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.229 -1.35 . . . . 0.48999999999999999 110.45 179.521 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.512 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 19.3 mt -76.28 -18.65 58.88 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.083 -0.508 . . . . 0.51000000000000001 111.295 -179.048 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.432 ' HG3' ' HB2' ' A' ' 85' ' ' GLU . 24.5 ttt180 -55.44 -47.06 76.61 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.194 -0.669 . . . . 3.4100000000000001 109.194 170.472 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 47.7 mm -61.8 -41.57 91.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.415 -0.812 . . . . 1.8300000000000001 110.314 175.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.512 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 62.7 m-70 -70.12 -23.81 63.08 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.8 -0.637 . . . . 0.45000000000000001 112.542 -177.541 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 22.2 m -85.52 -11.51 53.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.908 0.385 . . . . 1.21 111.062 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 87.9 22.85 40.67 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.693 -0.765 . . . . 1.25 111.9 -178.049 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.432 ' HB2' ' HG3' ' A' ' 80' ' ' ARG . 8.7 mm-40 -90.78 125.61 35.76 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.285 -0.635 . . . . 3.1800000000000002 109.285 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 51.8 tttp . . . . . 0 C--O 1.248 1.015 0 CA-C-N 115.744 -0.662 . . . . 6.25 110.621 -176.299 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.754 0 N-CA-C 112.245 -0.342 . . . . 1.54 112.245 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.477 ' HB2' ' HB3' ' A' ' 68' ' ' GLN . 17.4 Cg_exo -69.01 117.59 5.13 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 122.13 1.887 . . . . 1.27 111.13 174.69 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.694 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 83.6 mt -83.55 131.67 34.97 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.027 -0.988 . . . . 0.52000000000000002 111.001 -176.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.567 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 48.5 tptt -81.82 122.24 27.46 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.839 -0.619 . . . . 1.99 111.888 -171.062 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 42.3 t -91.73 96.9 10.68 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 107.406 -1.331 . . . . 0.46000000000000002 107.406 169.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 63' ' ' ARG . 59.7 mtt85 -57.49 -30.94 65.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.07 0.462 . . . . 3.8599999999999999 110.973 -177.361 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -69.18 -37.29 78.07 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.7 -0.682 . . . . 2.1800000000000002 110.987 -176.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' CYS . . . . . 0.418 ' HB3' ' HD3' ' A' ' 67' ' ' LYS . 67.7 m -94.57 -42.13 8.97 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 121.639 0.733 . . . . 0.32000000000000001 111.2 177.252 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.63 3.01 43.54 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-N 114.891 -1.05 . . . . 0.40000000000000002 111.32 -177.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.418 ' HD3' ' HB3' ' A' ' 65' ' ' CYS . 18.1 pttt -108.36 -178.24 3.55 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-O 120.886 0.374 . . . . 1.28 110.07 -176.644 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.694 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 79.6 mt-30 -141.35 147.28 37.83 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.718 -0.674 . . . . 1.77 111.356 -168.788 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.468 ' CD1' HD23 ' A' ' 75' ' ' LEU . 54.1 m-85 -126.81 125.0 40.97 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.403 -0.362 . . . . 0.87 111.256 -176.165 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.7 p -68.42 -22.21 64.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.369 -0.378 . . . . 1.77 111.877 -176.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.01 129.28 48.26 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.227 0.537 . . . . 0.90000000000000002 110.644 179.223 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.557 ' O ' ' HG2' ' A' ' 76' ' ' LYS . 40.7 t -65.59 -43.77 88.68 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.283 -0.871 . . . . 1.4199999999999999 111.039 -176.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.44 ' O ' ' HG3' ' A' ' 77' ' ' ARG . . . -68.72 -33.35 75.69 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.901 -0.666 . . . . 0.32000000000000001 111.983 179.049 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -57.68 -45.14 86.0 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.347 -0.612 . . . . 1.8100000000000001 109.347 176.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.468 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.2 tm? -71.04 -31.25 67.66 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.702 -0.681 . . . . 0.38 110.379 179.25 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.557 ' HG2' ' O ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -65.04 -50.75 65.01 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.886 0.374 . . . . 1.9299999999999999 109.999 176.851 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 73' ' ' GLY . 81.3 mtt180 -59.28 -39.19 82.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.673 0.749 . . . . 3.9199999999999999 109.573 174.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -63.18 -36.92 85.22 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.625 -1.17 . . . . 0.48999999999999999 111.45 -177.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.531 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 37.1 mt -85.74 -23.85 27.16 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 122.212 -0.305 . . . . 0.51000000000000001 111.242 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.444 ' HA ' ' O ' ' A' ' 85' ' ' GLU . 46.3 ttp180 -59.11 -38.64 80.04 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.924 -0.398 . . . . 3.4100000000000001 109.924 173.703 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 17.2 tt -82.22 -26.15 9.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 C-N-CA 120.83 -0.348 . . . . 1.8300000000000001 110.564 178.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.531 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 13.3 m-70 -66.29 -47.19 74.42 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.801 0.334 . . . . 0.45000000000000001 110.842 175.78 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.4 m -86.73 -13.16 46.13 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.295 -0.411 . . . . 1.21 110.962 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 88.15 -9.5 74.65 Favored Glycine 0 N--CA 1.453 -0.195 0 C-N-CA 121.007 -0.616 . . . . 1.25 111.738 -178.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.444 ' O ' ' HA ' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -150.76 167.35 27.69 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 122.659 0.384 . . . . 3.1800000000000002 110.421 -179.857 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 84.0 tttt . . . . . 0 C--O 1.243 0.736 0 CA-C-O 118.481 -0.771 . . . . 6.25 109.284 172.871 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.8 0 CA-C-O 119.644 -0.531 . . . . 1.54 112.065 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.838 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 81.7 Cg_exo -47.62 115.91 1.62 Allowed 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 122.45 2.1 . . . . 1.27 112.152 176.277 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.473 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 62.1 mt -130.71 123.94 30.41 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 115.812 -0.631 . . . . 0.52000000000000002 111.397 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.9 tptm -82.04 129.59 34.84 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.3 -0.864 . . . . 1.99 110.572 -174.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 47.3 t -86.39 97.07 10.24 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 108.119 -1.067 . . . . 0.46000000000000002 108.119 172.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 mtp180 -59.47 -23.77 63.01 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.721 0.296 . . . . 3.8599999999999999 111.56 -175.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -84.56 -20.97 30.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.531 -0.304 . . . . 2.1800000000000002 111.425 -178.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 55.4 m -107.2 -41.97 4.98 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.923 0.392 . . . . 0.32000000000000001 111.769 178.538 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.72 -3.11 42.04 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.742 -0.742 . . . . 0.40000000000000002 111.722 -179.187 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.42 -176.85 3.19 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 109.54 -0.541 . . . . 1.28 109.54 178.454 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -139.81 149.89 44.05 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 116.126 -0.488 . . . . 1.77 110.492 -162.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.838 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 55.7 m-85 -117.27 179.76 3.95 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 116.345 -0.389 . . . . 0.87 110.476 -179.299 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 25.4 p -129.54 17.83 5.84 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.129 0.49 . . . . 1.77 111.051 -179.25 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.631 ' HB ' ' CB ' ' A' ' 74' ' ' ASN . 22.7 m -141.97 129.46 21.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.92 -0.582 . . . . 0.90000000000000002 109.767 -179.019 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.473 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 11.9 m -66.2 -42.08 89.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.644 -0.707 . . . . 1.4199999999999999 111.296 -175.536 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.61 -35.42 59.21 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.449 -0.882 . . . . 0.32000000000000001 111.953 177.687 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.631 ' CB ' ' HB ' ' A' ' 71' ' ' THR . 43.6 t-20 -58.59 -50.68 72.94 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.706 0.289 . . . . 1.8100000000000001 110.319 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.489 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.2 tm? -75.41 -32.49 60.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.112 -0.495 . . . . 0.38 111.184 -175.408 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.61 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -69.7 -45.11 68.99 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.84 -0.744 . . . . 1.9299999999999999 110.186 -178.575 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 9.7 tpp180 -62.7 -33.51 75.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.758 0.79 . . . . 3.9199999999999999 109.414 174.392 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.435 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 65.8 t60 -65.0 -39.0 92.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.421 -1.263 . . . . 0.48999999999999999 110.706 177.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.505 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 54.3 mt -81.83 -23.63 36.32 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.534 -0.303 . . . . 0.51000000000000001 111.808 -179.446 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.814 ' HA ' ' O ' ' A' ' 85' ' ' GLU . 71.6 ttt180 -62.28 -40.09 95.1 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.678 -0.489 . . . . 3.4100000000000001 109.678 173.965 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.5 tt -83.25 -10.82 11.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-O 121.07 0.462 . . . . 1.8300000000000001 110.86 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.505 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 13.6 m-70 -86.35 -47.3 9.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.263 -0.426 . . . . 0.45000000000000001 110.501 173.607 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.0 m -85.68 -25.75 26.35 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.034 -0.53 . . . . 1.21 111.056 -174.024 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 95.02 -0.82 64.59 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 110.999 -0.841 . . . . 1.25 110.999 -175.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.814 ' O ' ' HA ' ' A' ' 80' ' ' ARG . 4.5 pt-20 -150.42 -179.85 7.56 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.416 -0.392 . . . . 3.1800000000000002 111.341 -177.864 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt . . . . . 0 C--O 1.246 0.908 0 O-C-N 124.361 1.038 . . . . 6.25 112.292 -177.461 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.666 0 CA-C-O 119.651 -0.527 . . . . 1.54 112.107 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -55.78 116.45 3.17 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.664 2.242 . . . . 1.27 112.491 -178.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 88.7 mt -121.0 103.64 9.2 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.361 -1.29 . . . . 0.52000000000000002 110.309 177.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.929 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 24.4 mtmm -78.99 130.19 35.27 Favored 'General case' 0 CA--C 1.511 -0.529 0 C-N-CA 120.389 -0.524 . . . . 1.99 110.806 -175.673 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 35.7 t -68.35 110.29 4.03 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 108.593 -0.891 . . . . 0.46000000000000002 108.593 170.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 ttp180 -57.93 -30.43 65.94 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 123.171 0.294 . . . . 3.8599999999999999 111.741 -175.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -85.29 -26.78 26.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.57 -0.286 . . . . 2.1800000000000002 111.663 -174.577 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 93.6 m -103.15 -40.24 6.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.968 0.413 . . . . 0.32000000000000001 111.278 -178.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.75 -1.11 52.32 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 121.141 -0.552 . . . . 0.40000000000000002 112.043 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.4 ' HE3' ' CE1' ' A' ' 78' ' ' HIS . 0.0 OUTLIER -108.95 129.86 55.44 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 122.129 0.966 . . . . 1.28 110.739 -179.802 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.929 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 12.1 pt20 -81.33 161.9 23.65 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 113.384 -1.735 . . . . 1.77 112.917 -176.772 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.586 ' CD1' HD23 ' A' ' 75' ' ' LEU . 34.1 m-85 -130.92 131.8 44.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.702 -1.136 . . . . 0.87 109.446 176.128 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.7 t -84.05 -4.53 58.82 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.005 0.431 . . . . 1.77 111.147 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.2 m -115.52 129.27 56.48 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.264 0.554 . . . . 0.90000000000000002 110.201 179.245 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.8 p -65.65 -50.06 66.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.177 -0.919 . . . . 1.4199999999999999 111.854 -175.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.65 -29.52 67.17 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.839 -0.696 . . . . 0.32000000000000001 112.575 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.462 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 6.0 m120 -68.59 -55.02 12.98 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.327 0.108 . . . . 1.8100000000000001 110.766 176.709 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.586 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.1 tm? -69.82 -32.23 70.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.624 -0.262 . . . . 0.38 111.123 -175.411 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 20.8 mmmt -67.68 -51.62 47.49 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.733 -0.387 . . . . 1.9299999999999999 111.328 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -64.68 -29.13 70.12 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.592 0.71 . . . . 3.9199999999999999 109.565 176.322 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.462 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 53.3 t60 -64.44 -48.86 73.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.972 -1.013 . . . . 0.48999999999999999 110.587 177.005 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.497 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 33.1 mt -79.49 -19.55 49.44 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.723 0.296 . . . . 0.51000000000000001 111.04 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.534 ' HG3' ' HB3' ' A' ' 85' ' ' GLU . 60.8 ttt180 -58.54 -48.68 80.06 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.062 -0.517 . . . . 3.4100000000000001 110.385 175.014 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.0 tt -72.3 -30.14 34.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.459 -0.337 . . . . 1.8300000000000001 110.326 178.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.497 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 33.4 m-70 -64.21 -41.24 97.13 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.104 0.478 . . . . 0.45000000000000001 110.791 174.747 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 10.8 t -74.38 -12.05 60.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.965 -0.561 . . . . 1.21 110.589 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 86.46 23.23 44.3 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 121.021 -0.609 . . . . 1.25 112.661 177.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.534 ' HB3' ' HG3' ' A' ' 80' ' ' ARG . 7.1 tp10 -80.52 90.06 5.67 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 121.333 0.587 . . . . 3.1800000000000002 109.942 179.507 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 57.9 tptt . . . . . 0 C--O 1.248 1.021 0 CA-C-N 115.35 -0.841 . . . . 6.25 109.963 -179.614 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 95.5 mt . . . . . 0 N--CA 1.451 -0.394 0 CA-C-O 121.179 0.514 . . . . 0.52 110.821 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.406 ' HD3' ' O ' ' A' ' 67' ' ' LYS . 15.2 tppt? -81.77 128.75 34.32 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.489 -0.778 . . . . 1.99 110.865 -174.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 43.2 t -91.47 101.91 14.58 Favored 'General case' 0 N--CA 1.439 -0.989 0 N-CA-C 108.617 -0.883 . . . . 0.46 108.617 171.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -55.75 -31.92 62.97 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.602 0.564 . . . . 3.86 111.131 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -73.14 -45.53 56.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.004 -0.544 . . . . 2.18 111.479 -177.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.565 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 65.9 m -86.63 -41.08 14.53 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.381 0.61 . . . . 0.32 110.712 -176.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.68 -0.56 52.61 Favored Glycine 0 N--CA 1.443 -0.891 0 N-CA-C 110.657 -0.977 . . . . 0.4 110.657 -176.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.565 ' HG2' ' HB2' ' A' ' 65' ' ' CYS . 18.4 ptmt -92.17 -177.66 4.74 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.067 -0.567 . . . . 1.28 109.894 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.481 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 36.1 tt0 -156.72 137.1 12.97 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.603 -0.726 . . . . 1.77 110.463 -171.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.543 ' CD1' HD23 ' A' ' 75' ' ' LEU . 62.3 m-85 -109.96 -174.69 2.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.226 -0.443 . . . . 0.87 110.132 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.4 t -140.86 17.41 2.31 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.757 0.789 . . . . 1.77 108.948 170.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 16.9 m -131.89 128.69 39.11 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.142 -0.936 . . . . 0.9 109.555 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.9 t -65.03 -52.37 56.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.982 -1.008 . . . . 1.42 112.229 -172.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.57 -40.59 98.05 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.979 -0.629 . . . . 0.32 112.899 -176.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -63.65 -47.19 82.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.618 0.209 . . . . 1.81 111.455 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.543 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.8 tm? -72.47 -35.72 68.28 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.263 -0.273 . . . . 0.38 110.263 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.1 mmmt -62.6 -52.72 62.26 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.956 -0.298 . . . . 1.93 110.958 177.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -61.43 -32.36 72.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.22 0.533 . . . . 3.92 110.215 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -65.57 -45.64 82.55 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.394 -0.821 . . . . 0.49 110.764 178.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.548 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 23.4 mt -79.77 -19.16 49.33 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.923 0.392 . . . . 0.51 110.644 -179.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -58.8 -47.55 84.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.919 -0.582 . . . . 3.41 109.556 173.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 65.4 mt -64.1 -41.28 91.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.511 -0.768 . . . . 1.83 110.132 176.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.548 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 36.3 m-70 -60.31 -40.35 90.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.641 -0.708 . . . . 0.45 111.741 178.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 28.4 m . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 116.338 -0.392 . . . . 1.21 111.572 -176.507 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.524 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 79.6 mt . . . . . 0 CA--C 1.514 -0.417 0 CA-C-O 121.016 0.436 . . . . 0.52 110.604 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.409 ' HD2' ' O ' ' A' ' 67' ' ' LYS . 21.5 tptm -82.11 128.85 34.54 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.552 -0.749 . . . . 1.99 111.279 -171.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 54.1 t -89.76 106.5 18.51 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 107.715 -1.217 . . . . 0.46 107.715 171.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.4 mtm180 -64.13 -35.88 82.2 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.373 0.606 . . . . 3.86 110.013 -175.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -68.02 -36.01 79.25 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.931 -1.031 . . . . 2.18 111.381 -177.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 90.4 m -97.44 -42.07 7.9 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.088 0.471 . . . . 0.32 111.834 -178.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.98 4.52 48.05 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 121.021 -0.609 . . . . 0.4 111.622 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.409 ' O ' ' HD2' ' A' ' 61' ' ' LYS . 17.0 ptmt -103.92 -176.28 3.04 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 123.273 0.629 . . . . 1.28 109.354 179.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.461 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 17.2 pt20 -148.4 151.86 35.99 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 120.799 0.333 . . . . 1.77 111.247 -174.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.54 ' CD1' HD23 ' A' ' 75' ' ' LEU . 58.8 m-85 -117.58 176.18 5.29 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 116.166 -0.47 . . . . 0.87 110.412 -176.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 76.3 p -112.81 -21.23 11.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.889 0.376 . . . . 1.77 111.535 -177.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.6 p -112.22 134.16 53.93 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.409 0.623 . . . . 0.9 111.389 -175.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.524 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 23.3 m -64.01 -46.39 84.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.946 -1.025 . . . . 1.42 111.891 -175.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.9 -35.2 78.76 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.43 -0.89 . . . . 0.32 112.341 -177.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -68.48 -42.68 78.33 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.629 0.252 . . . . 1.81 110.693 -176.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.54 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.4 tm? -72.51 -41.29 66.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.516 -0.311 . . . . 0.38 110.825 -179.27 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.51 -41.84 79.4 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.269 -0.572 . . . . 1.93 110.766 -177.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -62.15 -36.54 82.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.222 0.534 . . . . 3.92 109.788 172.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . 0.416 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 82.0 t60 -63.26 -47.84 80.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.376 -0.829 . . . . 0.49 111.034 177.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.484 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 35.0 mt -73.29 -19.6 61.01 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 121.197 -0.201 . . . . 0.51 111.328 -177.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -64.91 -38.71 91.86 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.188 -0.671 . . . . 3.41 109.188 171.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 54.8 mt -66.08 -37.14 79.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.854 -0.612 . . . . 1.83 109.64 176.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.484 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 21.6 m-70 -67.51 -33.76 75.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.449 -0.796 . . . . 0.45 111.658 178.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 29.2 t . . . . . 0 C--N 1.322 -0.606 0 CA-C-O 120.873 0.368 . . . . 1.21 111.554 -177.56 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 72' ' ' SER . 59.7 mt . . . . . 0 CA--C 1.517 -0.319 0 CA-C-O 121.026 0.441 . . . . 0.52 110.816 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -82.14 131.38 35.24 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.429 -0.805 . . . . 1.99 111.758 -170.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 48.6 t -97.38 118.2 33.32 Favored 'General case' 0 N--CA 1.438 -1.057 0 N-CA-C 107.795 -1.187 . . . . 0.46 107.795 169.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.48 ' H ' ' HD3' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -73.35 -40.45 64.41 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.199 0.523 . . . . 3.86 110.141 -174.335 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -66.43 -36.59 83.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.133 -0.939 . . . . 2.18 110.798 -176.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 94.2 m -92.6 -41.18 10.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.101 -0.499 . . . . 0.32 110.987 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.56 9.89 54.22 Favored Glycine 0 N--CA 1.451 -0.315 0 N-CA-C 111.409 -0.676 . . . . 0.4 111.409 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -110.63 -176.25 2.93 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 123.574 0.75 . . . . 1.28 109.532 -178.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.49 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 3.8 pt20 -138.9 156.23 47.44 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 116.012 -0.54 . . . . 1.77 110.887 -177.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.646 ' CD1' HD23 ' A' ' 75' ' ' LEU . 40.1 m-85 -122.04 128.62 51.61 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.165 -0.47 . . . . 0.87 111.106 -178.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -69.23 -14.93 63.24 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.977 -0.556 . . . . 1.77 111.689 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 24.4 m -112.8 129.05 56.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.037 0.446 . . . . 0.9 110.274 -178.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.518 ' HA ' HD12 ' A' ' 60' ' ' LEU . 7.8 m -69.31 -53.63 18.72 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.401 -0.818 . . . . 1.42 112.333 -172.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.57 -27.87 73.54 Favored Glycine 0 CA--C 1.508 -0.366 0 C-N-CA 120.697 -0.763 . . . . 0.32 112.0 -178.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -66.47 -44.53 82.46 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.855 -0.424 . . . . 1.81 109.855 178.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.646 HD23 ' CD1' ' A' ' 69' ' ' PHE . 2.5 tm? -67.7 -39.97 84.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.484 . . . . 0.38 110.067 178.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.564 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 3.5 mmpt? -61.9 -43.3 99.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.873 0.368 . . . . 1.93 110.829 177.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.461 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 41.6 ttm180 -66.57 -38.82 87.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.164 -0.471 . . . . 3.92 110.58 175.157 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -64.02 -47.27 80.92 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.879 -0.601 . . . . 0.49 111.433 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.579 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 18.5 mt -75.09 -19.77 59.8 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 121.056 -0.257 . . . . 0.51 110.967 -178.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.461 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 0.3 OUTLIER -57.48 -46.13 84.04 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.938 -0.764 . . . . 3.41 108.938 170.556 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 52.3 mt -68.18 -38.09 79.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.351 -0.84 . . . . 1.83 110.545 178.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.579 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 16.5 m-70 -61.84 -31.22 71.45 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.282 -0.417 . . . . 0.45 111.311 177.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.1 m . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 116.083 -0.508 . . . . 1.21 111.157 -178.858 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.63 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 75.0 mt . . . . . 0 CA--C 1.514 -0.423 0 CA-C-O 120.929 0.395 . . . . 0.52 111.568 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 36.4 tptt -81.59 117.53 22.04 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.727 -0.669 . . . . 1.99 110.929 -172.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 40.4 t -78.57 112.67 15.88 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.086 -0.709 . . . . 0.46 109.086 174.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 63.8 ttt180 -59.95 -36.99 78.25 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.054 -0.521 . . . . 3.86 111.43 -177.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.3 mp0 -76.52 -36.01 57.97 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.029 -0.532 . . . . 2.18 111.79 -176.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.479 ' HB3' ' HD3' ' A' ' 67' ' ' LYS . 80.1 m -93.34 -41.34 9.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.099 0.476 . . . . 0.32 111.584 -177.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.8 -0.75 59.43 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.539 -0.755 . . . . 0.4 111.617 -176.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.479 ' HD3' ' HB3' ' A' ' 65' ' ' CYS . 12.2 pttt -103.72 -177.78 3.47 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 108.762 -0.829 . . . . 1.28 108.762 178.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.63 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 13.4 pt20 -145.67 156.5 43.68 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 116.484 -0.325 . . . . 1.77 111.327 -170.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.602 ' CD2' HD23 ' A' ' 75' ' ' LEU . 43.6 m-85 -131.03 137.82 49.35 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-N 116.03 -0.532 . . . . 0.87 111.416 -170.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.9 m -72.6 -32.69 66.17 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.48 -0.782 . . . . 1.77 112.011 -173.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.52 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 24.9 m -100.97 128.84 46.82 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.392 0.615 . . . . 0.9 110.379 -179.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.565 ' HA ' HD12 ' A' ' 60' ' ' LEU . 22.9 t -64.95 -44.71 88.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.211 -0.904 . . . . 1.42 110.964 -176.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.53 -31.11 79.12 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.842 -0.694 . . . . 0.32 112.088 177.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.52 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 5.2 t30 -67.75 -45.58 74.56 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.78 -0.452 . . . . 1.81 109.78 178.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.602 HD23 ' CD2' ' A' ' 69' ' ' PHE . 1.5 tm? -68.63 -35.35 77.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.003 -0.544 . . . . 0.38 109.698 178.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.578 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -63.15 -47.83 81.06 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.891 -0.411 . . . . 1.93 109.891 177.861 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.493 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 7.8 tpt180 -63.69 -38.7 92.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.29 0.567 . . . . 3.92 110.355 175.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -61.48 -41.88 97.94 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.475 -0.784 . . . . 0.49 110.502 177.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 31.6 mt -75.85 -19.56 58.8 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.27 -0.423 . . . . 0.51 111.349 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.493 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 27.3 ttt85 -61.05 -44.07 97.93 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.587 -0.523 . . . . 3.41 109.587 173.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 48.2 mm -61.3 -46.19 97.11 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.527 -0.761 . . . . 1.83 110.086 175.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -58.26 -43.03 87.69 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.671 -0.695 . . . . 0.45 111.436 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 24.2 m . . . . . 0 C--N 1.325 -0.482 0 CA-C-N 116.144 -0.48 . . . . 1.21 111.601 -177.29 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.49 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 97.6 mt . . . . . 0 C--O 1.223 -0.299 0 CA-C-O 121.066 0.46 . . . . 0.52 111.35 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.6 tptp -81.47 132.68 35.33 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.835 -0.621 . . . . 1.99 111.112 -172.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 53.2 t -93.91 116.64 29.11 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.062 -1.088 . . . . 0.46 108.062 171.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 46.9 mtp180 -71.9 -37.33 70.13 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.992 0.425 . . . . 3.86 111.143 -176.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.456 ' OE2' ' HB3' ' A' ' 82' ' ' HIS . 4.5 mp0 -65.6 -35.34 80.53 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.887 -0.597 . . . . 2.18 111.734 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.42 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 85.8 m -98.42 -40.5 8.25 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.948 0.404 . . . . 0.32 111.512 -178.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 103.7 -6.52 48.71 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 111.442 -0.663 . . . . 0.4 111.442 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.601 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 17.7 ptmt -90.37 -176.35 4.77 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.058 -0.571 . . . . 1.28 110.438 -177.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -143.18 141.43 31.14 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.369 -0.832 . . . . 1.77 109.905 -172.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.601 ' CE1' ' HE2' ' A' ' 67' ' ' LYS . 6.6 m-85 -108.53 174.12 6.01 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 110.214 -0.291 . . . . 0.87 110.214 -177.007 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 64.8 p -119.65 -31.74 4.48 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.976 0.417 . . . . 1.77 110.812 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.1 p -97.71 129.34 44.76 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.507 0.67 . . . . 0.9 110.815 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.49 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 20.2 p -64.87 -42.84 94.51 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.143 -0.935 . . . . 1.42 112.023 -173.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.08 -32.55 76.94 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.551 -0.833 . . . . 0.32 112.003 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -67.6 -43.65 80.01 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 121.315 -0.154 . . . . 1.81 111.005 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.526 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.5 tm? -74.28 -35.17 63.74 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 121.04 -0.264 . . . . 0.38 110.429 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.558 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -60.5 -55.05 38.11 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.473 0.178 . . . . 1.93 111.309 178.384 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -62.57 -30.7 71.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.289 0.566 . . . . 3.92 110.045 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -69.21 -43.1 74.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.331 -0.85 . . . . 0.49 111.751 -178.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.508 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 18.0 mt -79.15 -23.87 43.69 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.179 -0.609 . . . . 0.51 110.801 -178.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -58.27 -47.66 82.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.091 -0.504 . . . . 3.41 110.324 173.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.7 tt -73.36 -32.47 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-O 120.688 0.28 . . . . 1.83 110.682 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.508 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 6.7 m-70 -58.17 -49.86 75.55 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.061 0.458 . . . . 0.45 110.646 174.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 24.1 m . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 115.854 -0.612 . . . . 1.21 111.58 -178.545 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.584 HD12 ' HA ' ' A' ' 72' ' ' SER . 36.4 mt . . . . . 0 CA--C 1.511 -0.522 0 CA-C-O 120.948 0.404 . . . . 0.52 110.961 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.678 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 71.5 tttt -81.2 120.69 25.2 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.132 -0.486 . . . . 1.99 110.913 -175.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 16.9 t -69.18 127.98 35.02 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 109.171 -0.677 . . . . 0.46 109.171 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 36.2 ttt-85 -66.52 -47.34 73.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.956 -0.566 . . . . 3.86 111.345 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.2 mp0 -72.37 -39.53 67.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.16 -0.473 . . . . 2.18 111.77 -174.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.459 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 89.3 m -88.82 -40.52 13.1 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.2 0.524 . . . . 0.32 110.651 -177.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 93.77 8.48 60.65 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 115.213 -0.903 . . . . 0.4 111.381 -174.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.459 ' HG2' ' HB2' ' A' ' 65' ' ' CYS . 0.0 OUTLIER -109.41 129.76 55.53 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 122.04 0.924 . . . . 1.28 110.829 -175.727 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.678 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 14.5 mt-30 -86.62 147.78 25.76 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 113.826 -1.534 . . . . 1.77 112.218 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.569 ' CD1' HD23 ' A' ' 75' ' ' LEU . 24.8 m-85 -118.31 127.35 53.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.398 -0.819 . . . . 0.87 110.077 177.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.7 t -74.22 -18.78 60.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.812 0.339 . . . . 1.77 110.656 -178.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.8 m -101.74 127.94 48.28 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.538 -0.541 . . . . 0.9 109.538 176.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.584 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.1 m -70.52 -44.12 68.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.73 -0.668 . . . . 1.42 111.756 -172.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.519 ' O ' ' HG2' ' A' ' 77' ' ' ARG . . . -65.26 -36.73 93.15 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.567 -0.825 . . . . 0.32 112.234 178.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.7 -48.8 78.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.706 0.289 . . . . 1.81 110.407 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.569 HD23 ' CD1' ' A' ' 69' ' ' PHE . 2.2 tm? -67.31 -35.27 79.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.085 -0.507 . . . . 0.38 110.369 -179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.604 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -65.89 -45.42 82.1 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 110.234 -0.284 . . . . 1.93 110.234 179.787 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.672 ' O ' ' HG2' ' A' ' 80' ' ' ARG . 23.7 mmt180 -62.35 -41.83 98.9 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.493 0.663 . . . . 3.92 109.515 173.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -58.27 -44.82 88.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.026 -0.988 . . . . 0.49 111.463 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.464 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 18.7 mt -79.61 -25.91 41.35 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.417 0.525 . . . . 0.51 112.417 -176.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.672 ' HG2' ' O ' ' A' ' 77' ' ' ARG . 12.5 ptm180 -70.24 -18.7 63.15 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.204 -0.598 . . . . 3.41 109.461 177.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.541 HG12 ' O ' ' A' ' 77' ' ' ARG . 41.0 mm -81.12 -32.45 12.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.124 -0.695 . . . . 1.83 109.124 171.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.464 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 20.6 m-70 -68.83 -41.2 78.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.077 -0.965 . . . . 0.45 111.33 178.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.3 p . . . . . 0 C--N 1.324 -0.542 0 CA-C-O 121.068 0.461 . . . . 1.21 111.091 178.497 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.519 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 83.6 mt . . . . . 0 N--CA 1.45 -0.45 0 CA-C-O 121.205 0.526 . . . . 0.52 110.557 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -82.26 127.88 33.63 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.19 -0.914 . . . . 1.99 111.481 -172.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 52.5 t -88.48 106.9 18.58 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 108.578 -0.897 . . . . 0.46 108.578 170.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -63.01 -30.11 71.35 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.133 -0.485 . . . . 3.86 111.648 -174.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -85.32 -26.28 26.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.301 -0.409 . . . . 2.18 111.461 -174.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 79.8 m -99.68 -42.58 6.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.04 0.447 . . . . 0.32 111.666 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.36 -10.04 42.52 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.269 -0.732 . . . . 0.4 111.269 -176.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.512 ' HE3' ' CZ ' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -81.22 -178.11 6.77 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 121.088 0.47 . . . . 1.28 110.099 179.834 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.504 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 27.7 tt0 -160.34 141.22 11.99 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 115.311 -0.859 . . . . 1.77 110.378 -172.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.512 ' CZ ' ' HE3' ' A' ' 67' ' ' LYS . 96.1 m-85 -118.41 172.65 7.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.853 0.358 . . . . 0.87 111.425 -175.011 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.2 t -119.46 -10.53 9.65 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.549 0.69 . . . . 1.77 109.243 172.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 22.8 m -99.13 128.84 45.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.734 -0.667 . . . . 0.9 110.031 177.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.519 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 14.0 m -70.61 -51.13 30.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.611 -0.722 . . . . 1.42 111.419 -174.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.414 ' O ' ' HG3' ' A' ' 77' ' ' ARG . . . -62.33 -33.95 87.74 Favored Glycine 0 CA--C 1.51 -0.276 0 C-N-CA 120.867 -0.682 . . . . 0.32 112.631 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -60.8 -54.48 44.64 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.908 -0.404 . . . . 1.81 109.908 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.461 ' HG ' ' HB3' ' A' ' 60' ' ' LEU . 1.5 tm? -70.21 -32.14 69.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.842 0.353 . . . . 0.38 110.923 -177.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.449 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -66.64 -44.98 80.5 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.411 -0.516 . . . . 1.93 110.6 -178.741 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.414 ' HG3' ' O ' ' A' ' 73' ' ' GLY . 24.4 mtm-85 -69.4 -33.07 72.45 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.462 0.649 . . . . 3.92 109.823 175.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . 0.402 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 56.6 t60 -58.5 -51.63 69.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.961 -1.018 . . . . 0.49 110.465 176.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.565 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 32.8 mt -75.57 -18.92 59.61 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.177 -0.465 . . . . 0.51 111.109 178.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 49.8 ttp180 -58.01 -48.29 80.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.308 -0.405 . . . . 3.41 109.966 177.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 38.5 pt -77.22 -25.4 15.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 1.83 110.981 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.565 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 21.9 m-70 -65.44 -47.31 76.61 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.831 0.348 . . . . 0.45 111.195 176.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.2 m . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 116.233 -0.44 . . . . 1.21 111.405 -177.52 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 87.9 mt . . . . . 0 CA--C 1.515 -0.369 0 CA-C-O 120.735 0.303 . . . . 0.52 111.144 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.651 ' HD2' ' HB3' ' A' ' 68' ' ' GLN . 2.5 mptm? -80.39 129.95 34.85 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.324 -0.398 . . . . 1.99 111.053 -176.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 37.1 t -75.33 114.55 13.99 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.711 -0.848 . . . . 0.46 108.711 170.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 63' ' ' ARG . 23.7 ttt180 -53.73 -46.13 70.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.402 -0.817 . . . . 3.86 112.119 -176.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 30.1 mp0 -75.87 -31.36 59.23 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.106 -0.497 . . . . 2.18 112.009 -174.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 91.6 m -98.27 -40.47 8.33 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.231 0.456 . . . . 0.32 112.231 -174.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 100.43 -0.92 55.75 Favored Glycine 0 N--CA 1.455 -0.098 0 C-N-CA 120.874 -0.679 . . . . 0.4 111.824 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -93.1 -175.7 3.94 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 109.303 -0.629 . . . . 1.28 109.303 179.171 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.651 ' HB3' ' HD2' ' A' ' 61' ' ' LYS . 20.6 pt20 -141.38 150.21 42.11 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.001 0.429 . . . . 1.77 111.703 -171.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.556 ' CD1' HD23 ' A' ' 75' ' ' LEU . 58.6 m-85 -118.94 177.42 4.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.827 -0.624 . . . . 0.87 109.825 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.4 p -120.26 0.35 10.61 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.171 0.51 . . . . 1.77 111.146 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.652 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 8.3 m -126.71 130.02 49.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.876 -0.602 . . . . 0.9 110.163 -175.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.419 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 49.6 m -63.23 -51.25 67.0 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.597 -0.729 . . . . 1.42 111.646 -177.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.4 -28.6 73.16 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.854 -0.689 . . . . 0.32 111.873 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.652 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 41.3 t-20 -64.58 -50.67 66.33 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.705 -0.48 . . . . 1.81 109.705 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.556 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.3 tm? -65.78 -38.87 90.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.31 -0.405 . . . . 0.38 110.377 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.8 mmmt -66.04 -47.9 72.86 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.831 -0.348 . . . . 1.93 111.18 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.412 ' O ' HG13 ' A' ' 81' ' ' ILE . 42.8 ttm180 -60.06 -41.57 92.65 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.234 0.54 . . . . 3.92 109.829 175.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -59.97 -45.03 94.02 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.135 -0.939 . . . . 0.49 111.273 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.617 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 34.1 mt -78.04 -19.54 54.13 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.666 -0.414 . . . . 0.51 110.952 -176.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -69.58 -33.08 72.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.03 -0.73 . . . . 3.41 109.03 172.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 77' ' ' ARG . 70.7 mt -75.67 -32.06 23.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.392 -0.822 . . . . 1.83 110.024 174.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.617 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 6.1 m-70 -65.53 -37.54 87.03 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.166 -0.47 . . . . 0.45 111.375 176.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 51.8 p . . . . . 0 C--N 1.324 -0.512 0 CA-C-O 121.085 0.469 . . . . 1.21 110.68 177.935 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.471 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 95.8 mt . . . . . 0 CA--C 1.516 -0.343 0 N-CA-C 108.299 -1.0 . . . . 0.52 108.299 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.762 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 51.8 tttp -80.63 126.23 31.0 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.462 0.649 . . . . 1.99 112.501 -162.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 51.2 t -82.32 105.58 13.51 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 115.141 -0.936 . . . . 0.46 108.514 174.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -62.91 -29.31 70.68 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.776 0.322 . . . . 3.86 111.198 -176.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -79.4 -30.86 42.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.91 0.337 . . . . 2.18 111.91 -176.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 67.0 m -94.91 -41.94 8.93 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.461 0.648 . . . . 0.32 110.679 176.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.05 -12.1 34.26 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.092 -0.958 . . . . 0.4 111.437 -177.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.573 ' O ' ' HD2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -110.83 128.78 55.9 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 122.399 1.095 . . . . 1.28 111.451 -177.048 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.762 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -78.73 164.34 24.65 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 113.333 -1.758 . . . . 1.77 112.75 174.781 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -122.25 143.71 49.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.973 -1.012 . . . . 0.87 110.356 176.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.0 t -91.65 7.03 43.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.075 0.464 . . . . 1.77 110.735 177.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.452 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 3.9 m -126.22 129.57 49.23 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.735 -0.468 . . . . 0.9 109.735 179.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.471 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 22.8 t -69.51 -50.76 42.13 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.621 -0.718 . . . . 1.42 111.733 -172.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.2 -34.94 90.74 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.51 -0.852 . . . . 0.32 111.833 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.452 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 4.7 m-20 -62.11 -50.75 70.67 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.576 -0.157 . . . . 1.81 110.576 178.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.453 ' O ' HD22 ' A' ' 75' ' ' LEU . 0.6 OUTLIER -68.97 -37.01 78.54 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 123.162 0.288 . . . . 0.38 110.796 -177.489 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.556 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -62.44 -52.26 64.24 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.67 -0.412 . . . . 1.93 110.47 178.272 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 77' ' ' ARG . 27.9 mtp180 -62.94 -30.4 71.53 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.427 0.632 . . . . 3.92 110.414 176.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . 0.444 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 69.8 t60 -66.32 -50.81 62.35 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.946 -1.024 . . . . 0.49 110.695 178.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.557 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 42.8 mt -75.92 -19.73 58.55 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.769 0.319 . . . . 0.51 110.807 179.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -58.93 -49.58 77.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.96 -0.564 . . . . 3.41 109.798 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.0 tp -73.78 -30.38 28.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.037 -0.529 . . . . 1.83 110.47 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.557 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 22.9 m-70 -61.84 -46.44 89.44 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.698 0.285 . . . . 0.45 111.109 176.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.3 m . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 116.027 -0.533 . . . . 1.21 111.252 -176.109 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.56 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 96.6 mt . . . . . 0 N--CA 1.448 -0.571 0 CA-C-O 121.188 0.518 . . . . 0.52 111.167 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 45.5 tptt -81.92 114.03 20.24 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.325 -0.852 . . . . 1.99 109.89 -176.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 41.8 t -70.75 109.53 5.01 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.43 -0.582 . . . . 0.46 109.43 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -58.41 -27.3 64.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.802 -0.636 . . . . 3.86 111.483 -177.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -93.43 -20.05 20.69 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.747 0.647 . . . . 2.18 112.747 -175.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.446 ' HB3' ' HG3' ' A' ' 67' ' ' LYS . 64.4 m -105.87 -41.37 5.43 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.211 0.448 . . . . 0.32 112.211 178.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.91 -0.08 59.02 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.44 -0.886 . . . . 0.4 111.565 -175.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.446 ' HG3' ' HB3' ' A' ' 65' ' ' CYS . 0.0 OUTLIER -108.09 -178.36 3.59 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 109.182 -0.673 . . . . 1.28 109.182 176.104 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.56 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 27.6 tt0 -141.68 148.92 39.88 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 111.763 0.283 . . . . 1.77 111.763 -159.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.468 ' CD1' HD23 ' A' ' 75' ' ' LEU . 66.5 m-85 -126.19 140.52 52.49 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 120.815 0.341 . . . . 0.87 111.229 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.2 p -84.72 -22.25 29.8 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.281 -0.418 . . . . 1.77 111.406 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 4.6 m -104.72 129.9 52.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.853 -0.612 . . . . 0.9 110.411 -177.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.419 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 14.6 m -60.59 -47.87 84.28 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.343 -0.844 . . . . 1.42 111.857 -176.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.25 -32.97 85.95 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.934 -0.65 . . . . 0.32 112.431 -179.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.441 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 5.4 m-20 -62.24 -46.36 89.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.537 0.208 . . . . 1.81 110.873 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.468 HD23 ' CD1' ' A' ' 69' ' ' PHE . 2.1 tm? -77.18 -31.8 55.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.545 -0.298 . . . . 0.38 110.592 -177.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.515 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -67.21 -44.95 78.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.659 0.266 . . . . 1.93 110.955 177.817 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.463 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 70.7 ttt180 -66.07 -34.61 78.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.579 0.704 . . . . 3.92 109.771 174.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . 0.475 ' O ' HG22 ' A' ' 81' ' ' ILE . 77.6 t60 -65.83 -46.28 79.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.976 -1.011 . . . . 0.49 110.689 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.532 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 31.3 mt -74.27 -19.44 60.49 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.674 0.274 . . . . 0.51 110.803 177.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.463 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 70.4 ttt180 -60.32 -47.74 84.75 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.282 -0.417 . . . . 3.41 109.955 176.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.475 HG22 ' O ' ' A' ' 78' ' ' HIS . 11.3 tp -72.88 -25.83 22.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.303 -0.408 . . . . 1.83 110.36 177.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.532 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 32.3 m-70 -67.63 -41.44 83.91 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.048 0.452 . . . . 0.45 110.683 175.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 C--N 1.325 -0.477 0 CA-C-O 121.138 0.494 . . . . 1.21 110.352 179.786 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.588 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 67.0 mt . . . . . 0 CA--C 1.515 -0.398 0 CA-C-O 120.649 0.261 . . . . 0.52 110.676 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.502 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 11.4 tppt? -80.85 128.31 33.53 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.091 -0.504 . . . . 1.99 112.188 -171.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 41.2 t -90.9 99.29 12.35 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.577 -1.268 . . . . 0.46 107.577 166.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -63.78 -24.82 67.92 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 111.893 0.331 . . . . 3.86 111.893 -173.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -76.46 -30.61 57.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.677 -0.238 . . . . 2.18 111.489 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 67.6 m -97.5 -41.54 8.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.161 0.505 . . . . 0.32 111.141 178.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.55 6.5 50.19 Favored Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 110.827 -0.909 . . . . 0.4 110.827 -178.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.463 ' HE3' ' HE1' ' A' ' 69' ' ' PHE . 25.1 pttt -108.07 -177.57 3.37 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 108.972 -0.751 . . . . 1.28 108.972 -177.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.588 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 50.1 mt-30 -137.31 163.44 30.98 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 116.03 -0.532 . . . . 1.77 110.593 -174.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.542 ' CD1' HD23 ' A' ' 75' ' ' LEU . 14.1 m-85 -132.73 131.33 41.08 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-O 121.121 0.486 . . . . 0.87 110.885 -177.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.7 m -67.68 -26.69 66.32 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 114.799 -1.092 . . . . 1.77 112.529 -174.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.4 m -114.28 130.0 56.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.108 0.48 . . . . 0.9 110.255 -178.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.533 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.2 m -56.4 -45.53 80.59 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 114.997 -1.001 . . . . 1.42 111.825 -176.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.87 -34.51 90.12 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.634 -0.793 . . . . 0.32 112.086 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 4.1 m-20 -63.05 -44.96 94.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.212 0.054 . . . . 1.81 110.882 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.542 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.4 tm? -72.03 -38.39 69.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.847 0.356 . . . . 0.38 110.176 -178.518 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.594 ' O ' ' HG3' ' A' ' 80' ' ' ARG . 0.1 OUTLIER -62.53 -50.7 70.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.326 -0.397 . . . . 1.93 110.016 178.874 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -59.14 -40.97 87.17 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.627 0.727 . . . . 3.92 110.354 175.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . 0.436 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 77.2 t60 -58.04 -42.82 86.2 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.527 -1.215 . . . . 0.49 111.119 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.473 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 53.7 mt -79.66 -19.17 49.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.174 -0.466 . . . . 0.51 111.836 -177.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.594 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 25.4 mtp180 -62.75 -41.76 99.36 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.978 -0.749 . . . . 3.41 108.978 173.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 73.0 mt -65.61 -40.19 87.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.049 -0.978 . . . . 1.83 110.446 176.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.473 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 31.5 m-70 -65.65 -31.89 73.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.896 -0.593 . . . . 0.45 111.858 178.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.5 m . . . . . 0 C--N 1.324 -0.539 0 CA-C-O 120.717 0.294 . . . . 1.21 111.069 -178.079 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.668 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 61.1 mt . . . . . 0 CA--C 1.512 -0.491 0 CA-C-O 120.976 0.417 . . . . 0.52 111.076 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.669 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 15.7 ttpt -82.32 134.2 35.26 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.261 0.553 . . . . 1.99 111.033 -175.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 49.4 t -87.27 96.57 10.39 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 108.166 -1.05 . . . . 0.46 108.166 173.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -50.77 -37.71 43.82 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.528 0.517 . . . . 3.86 110.877 179.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.6 mp0 -65.06 -38.77 91.88 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.426 -0.806 . . . . 2.18 112.089 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.475 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 62.7 m -97.16 -41.16 8.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.124 0.488 . . . . 0.32 111.544 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 105.63 0.12 39.78 Favored Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 111.087 -0.805 . . . . 0.4 111.087 -177.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.574 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 14.8 ptmt -95.9 -178.39 4.34 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 115.064 -0.568 . . . . 1.28 109.905 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.669 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 32.4 tt0 -149.04 143.69 26.24 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 116.12 -0.491 . . . . 1.77 110.728 -174.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.552 ' CD1' HD23 ' A' ' 75' ' ' LEU . 53.9 m-85 -113.61 -173.99 2.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.977 -0.556 . . . . 0.87 109.803 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.5 t -134.87 18.86 3.5 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.44 0.638 . . . . 1.77 110.075 175.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 88.6 m -137.89 128.65 26.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.9 110.01 -178.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.668 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 5.3 p -64.14 -59.71 4.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.142 -0.935 . . . . 1.42 112.356 -175.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.18 -34.87 81.8 Favored Glycine 0 C--O 1.229 -0.177 0 C-N-CA 121.003 -0.618 . . . . 0.32 112.819 -177.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -65.08 -48.07 75.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.624 -0.139 . . . . 1.81 110.624 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.552 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.5 tm? -70.09 -37.78 75.5 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.564 -0.289 . . . . 0.38 110.446 -178.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.665 ' O ' ' HG2' ' A' ' 80' ' ' ARG . 7.8 mmpt? -61.19 -49.64 76.36 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.115 -0.328 . . . . 1.93 110.115 177.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -60.34 -40.72 91.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.453 0.644 . . . . 3.92 110.264 175.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . 0.423 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 74.4 t60 -56.04 -44.97 79.31 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.003 -0.998 . . . . 0.49 110.732 177.307 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.564 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 45.9 mt -80.17 -18.65 49.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.245 -0.434 . . . . 0.51 111.637 -178.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.665 ' HG2' ' O ' ' A' ' 76' ' ' LYS . 4.5 mmp_? -60.83 -45.49 94.27 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.91 -0.774 . . . . 3.41 108.91 171.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 66.8 mt -60.15 -41.3 86.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.154 -0.93 . . . . 1.83 109.963 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.564 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 39.6 m-70 -65.97 -15.19 62.78 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.879 -0.601 . . . . 0.45 111.632 177.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 33.8 t . . . . . 0 C--N 1.324 -0.531 0 CA-C-O 120.827 0.346 . . . . 1.21 110.764 179.413 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.953 ' HB3' HD12 ' A' ' 75' ' ' LEU . 75.6 mt . . . . . 0 C--O 1.219 -0.517 0 N-CA-C 109.876 -0.416 . . . . 0.52 109.876 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 10.5 tptm -127.12 127.0 43.9 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 120.897 0.379 . . . . 1.99 110.318 -178.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.731 ' SG ' ' CD2' ' A' ' 78' ' ' HIS . 0.5 OUTLIER -100.08 79.62 2.2 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 108.395 -0.965 . . . . 0.46 108.395 -176.214 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -51.1 -36.47 40.56 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 113.176 0.806 . . . . 3.86 113.176 -169.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.721 ' CD ' ' H ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER -65.98 -35.74 81.41 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.984 0.421 . . . . 2.18 110.33 178.614 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.401 ' HB2' ' HB3' ' A' ' 62' ' ' CYS . 72.5 m -92.59 -40.61 10.68 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.9 -0.591 . . . . 0.32 110.659 -176.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.9 11.48 49.77 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.718 -0.953 . . . . 0.4 110.718 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.517 ' HE3' ' CE1' ' A' ' 69' ' ' PHE . 46.0 pttt -108.0 -176.53 3.08 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 114.913 -0.644 . . . . 1.28 109.661 -177.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.448 HE21 ' HB2' ' A' ' 68' ' ' GLN . 1.2 pt20 -138.36 156.45 47.59 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 115.514 -0.766 . . . . 1.77 109.707 -175.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.723 ' CD1' ' HG ' ' A' ' 75' ' ' LEU . 41.8 m-85 -123.4 164.33 19.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.983 0.42 . . . . 0.87 110.683 178.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.2 t -121.21 9.89 10.54 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.47 -0.937 . . . . 1.77 108.47 173.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.471 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 32.0 m -137.74 127.82 25.9 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.739 -1.119 . . . . 0.9 109.956 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.413 ' HA ' HD11 ' A' ' 60' ' ' LEU . 19.9 t -71.18 -43.47 67.37 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.81 -0.632 . . . . 1.42 110.816 -177.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.2 -28.8 73.46 Favored Glycine 0 C--N 1.331 0.291 0 C-N-CA 120.907 -0.664 . . . . 0.32 112.678 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.471 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 34.3 m-20 -68.84 -51.57 39.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.456 0.17 . . . . 1.81 110.676 177.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.953 HD12 ' HB3' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -67.46 -37.58 83.17 Favored 'General case' 0 C--O 1.223 -0.323 0 N-CA-C 109.753 -0.462 . . . . 0.38 109.753 179.508 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.569 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -54.73 -52.64 61.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.91 0.386 . . . . 1.93 110.765 177.417 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -63.09 -40.53 97.92 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.321 0.581 . . . . 3.92 110.888 179.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . 0.731 ' CD2' ' SG ' ' A' ' 62' ' ' CYS . 78.0 t60 -69.5 -28.68 66.27 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.527 -0.761 . . . . 0.49 111.063 -178.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.674 ' HG ' HD22 ' A' ' 75' ' ' LEU . 79.7 mt -74.52 -28.24 60.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.92 0.391 . . . . 0.51 110.768 173.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -62.27 -42.26 99.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.018 -0.537 . . . . 3.41 109.928 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.9 tt -76.31 -24.7 16.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 116.27 -0.423 . . . . 1.83 110.725 176.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.559 ' NE2' ' NE2' ' A' ' 78' ' ' HIS . 11.6 m-70 -66.69 -36.51 82.67 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.795 0.331 . . . . 0.45 110.599 174.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.6 m . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.043 0.449 . . . . 1.21 111.085 178.196 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.534 HD12 ' HA ' ' A' ' 72' ' ' SER . 80.4 mt . . . . . 0 CA--C 1.515 -0.404 0 N-CA-C 110.195 -0.298 . . . . 0.52 110.195 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 2.4 mppt? -82.28 133.93 35.26 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.568 0.699 . . . . 1.99 111.663 -174.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.436 ' SG ' ' HB2' ' A' ' 64' ' ' GLU . 44.8 t -78.05 97.26 5.33 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 114.782 -1.099 . . . . 0.46 108.087 170.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -56.22 -22.74 31.26 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.201 0.524 . . . . 3.86 111.132 -177.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.436 ' HB2' ' SG ' ' A' ' 62' ' ' CYS . 16.3 mm-40 -72.44 -37.37 68.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.917 -0.583 . . . . 2.18 111.339 177.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.459 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 89.4 m -107.77 -41.45 5.0 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.594 0.59 . . . . 0.32 112.594 -173.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.89 -6.46 32.88 Favored Glycine 0 N--CA 1.452 -0.246 0 N-CA-C 111.416 -0.674 . . . . 0.4 111.416 -176.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.497 ' O ' ' HA ' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -85.67 -178.17 6.57 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 122.982 0.513 . . . . 1.28 109.655 178.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.52 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 20.0 pt20 -145.35 153.84 41.67 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 116.015 -0.539 . . . . 1.77 111.37 -172.254 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.512 ' CD1' HD23 ' A' ' 75' ' ' LEU . 56.9 m-85 -135.8 121.93 20.22 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.288 -0.415 . . . . 0.87 109.93 176.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.7 t -71.92 -10.81 60.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.113 0.483 . . . . 1.77 111.083 -177.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 18.7 m -110.76 129.85 55.73 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.985 -0.552 . . . . 0.9 110.218 178.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.534 ' HA ' HD12 ' A' ' 60' ' ' LEU . 49.2 m -65.81 -41.9 91.31 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.441 -0.8 . . . . 1.42 112.306 -173.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.04 -36.02 92.73 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.057 -0.592 . . . . 0.32 112.583 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -62.99 -50.24 71.51 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.401 -0.222 . . . . 1.81 110.401 178.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.512 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.1 tm? -68.19 -33.47 74.49 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.389 -0.369 . . . . 0.38 110.304 -178.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.557 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -65.46 -51.25 61.49 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.654 0.264 . . . . 1.93 110.459 178.045 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.479 ' O ' ' HD3' ' A' ' 77' ' ' ARG . 3.6 tmt_? -64.26 -34.49 78.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.313 0.578 . . . . 3.92 109.445 176.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -60.37 -51.92 67.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.452 -0.794 . . . . 0.49 110.94 177.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.476 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 31.3 mt -75.28 -19.66 59.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.384 -0.371 . . . . 0.51 111.315 -179.066 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.471 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 42.7 ttm180 -55.99 -54.89 39.35 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.445 -0.576 . . . . 3.41 109.445 171.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 45.9 mm -57.74 -40.29 74.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.68 -0.691 . . . . 1.83 109.956 178.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.476 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 45.4 m-70 -64.01 -28.01 69.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.562 -0.744 . . . . 0.45 112.091 178.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.1 m . . . . . 0 C--N 1.325 -0.49 0 CA-C-O 120.674 0.273 . . . . 1.21 111.455 -176.061 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.564 HD12 ' HA ' ' A' ' 72' ' ' SER . 91.6 mt . . . . . 0 CA--C 1.516 -0.356 0 CA-C-O 120.947 0.403 . . . . 0.52 110.782 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.1 tppt? -82.91 140.18 32.98 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.819 -0.628 . . . . 1.99 111.526 -174.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 45.7 t -96.86 95.38 7.82 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 107.746 -1.205 . . . . 0.46 107.746 164.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.3 ttp180 -52.17 -36.3 51.33 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 123.398 0.436 . . . . 3.86 111.748 -177.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -71.62 -35.13 70.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.1 -0.5 . . . . 2.18 111.355 -175.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.441 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 65.3 m -94.02 -41.48 9.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.168 0.509 . . . . 0.32 111.364 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 103.71 6.03 44.17 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 111.205 -0.758 . . . . 0.4 111.205 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.558 ' HE2' ' CZ ' ' A' ' 69' ' ' PHE . 11.5 ptmt -101.41 -177.31 3.4 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.101 -0.549 . . . . 1.28 109.912 -178.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.43 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 35.6 tt0 -150.86 142.23 23.37 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.748 -0.66 . . . . 1.77 110.078 -168.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.638 ' CD1' HD23 ' A' ' 75' ' ' LEU . 88.1 m-85 -123.6 150.64 43.87 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-O 120.824 0.345 . . . . 0.87 111.09 -174.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.4 p -90.91 -25.26 19.9 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.164 -0.471 . . . . 1.77 111.69 -177.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.486 HG23 ' CB ' ' A' ' 74' ' ' ASN . 0.5 OUTLIER -108.72 132.7 53.69 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.588 0.709 . . . . 0.9 110.648 -179.825 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.564 ' HA ' HD12 ' A' ' 60' ' ' LEU . 66.2 m -64.57 -43.8 92.73 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 114.763 -1.108 . . . . 1.42 111.787 -174.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.62 -33.47 86.74 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.574 -0.822 . . . . 0.32 112.326 -177.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.503 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 62.0 t30 -69.29 -40.56 77.64 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.096 -0.242 . . . . 1.81 110.371 -179.227 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.638 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.6 tm? -76.47 -34.68 58.68 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.586 0.231 . . . . 0.38 110.552 -179.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.571 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 8.8 mmpt? -64.85 -46.58 81.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.652 0.263 . . . . 1.93 110.35 177.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -60.95 -41.72 96.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.694 0.759 . . . . 3.92 109.736 174.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . 0.503 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 61.3 t60 -58.51 -46.88 85.81 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.292 -1.322 . . . . 0.49 111.23 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.563 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 28.8 mt -83.81 -18.86 36.24 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 111.919 0.34 . . . . 0.51 111.919 -176.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -61.86 -48.18 81.67 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.803 -0.443 . . . . 3.41 109.803 174.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 13.9 tt -70.14 -29.46 39.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.3 -0.409 . . . . 1.83 110.481 178.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.563 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 18.3 m-70 -63.65 -29.54 70.76 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.008 0.432 . . . . 0.45 110.29 173.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 47.5 m . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 115.986 -0.552 . . . . 1.21 111.126 -178.984 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.695 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 67.9 mt . . . . . 0 CA--C 1.515 -0.396 0 CA-C-O 121.07 0.462 . . . . 0.52 111.809 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 40.8 tptt -81.4 126.14 31.26 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.214 -0.903 . . . . 1.99 111.151 -172.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 28.8 t -80.39 117.29 21.01 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.721 -0.844 . . . . 0.46 108.721 171.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -60.23 -34.97 74.42 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.661 0.615 . . . . 3.86 112.661 -172.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -94.1 -21.59 19.02 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.64 -0.424 . . . . 2.18 111.943 -172.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.417 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 84.3 m -99.35 -41.07 7.59 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.648 -0.421 . . . . 0.32 111.961 -179.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.58 2.52 58.69 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.707 -0.758 . . . . 0.4 111.517 -177.447 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.677 ' HE3' ' CE1' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -90.7 -176.72 4.8 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 109.764 -0.458 . . . . 1.28 109.764 178.429 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.695 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 4.6 pt20 -150.0 148.35 28.95 Favored 'General case' 0 C--N 1.309 -1.196 0 CA-C-N 115.898 -0.592 . . . . 1.77 111.114 -173.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.677 ' CE1' ' HE3' ' A' ' 67' ' ' LYS . 32.1 m-85 -122.44 133.29 54.62 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.315 -0.402 . . . . 0.87 111.51 -176.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.4 t -74.14 -16.28 61.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.329 0.585 . . . . 1.77 110.32 177.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.53 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 13.1 m -109.91 128.95 55.68 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.047 -0.524 . . . . 0.9 110.136 177.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.558 ' HA ' HD12 ' A' ' 60' ' ' LEU . 42.5 t -69.16 -40.76 77.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.513 -0.767 . . . . 1.42 110.901 -176.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.36 -38.49 95.03 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.656 -0.783 . . . . 0.32 111.983 178.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.53 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 39.9 m-20 -61.05 -43.08 99.43 Favored 'General case' 0 C--O 1.221 -0.435 0 C-N-CA 121.434 -0.106 . . . . 1.81 110.927 178.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.523 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.6 tm? -69.79 -37.37 76.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.816 0.341 . . . . 0.38 110.267 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.544 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -66.96 -45.5 77.57 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.841 -0.344 . . . . 1.93 110.11 179.734 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.57 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 4.9 tmt_? -64.99 -33.91 77.18 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.441 0.639 . . . . 3.92 109.817 175.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . 0.433 ' O ' HG22 ' A' ' 81' ' ' ILE . 73.6 t60 -63.92 -43.77 94.92 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.307 -0.861 . . . . 0.49 110.616 177.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.602 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 44.1 mt -80.05 -18.59 49.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.942 0.401 . . . . 0.51 110.635 178.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.57 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 28.7 tpt180 -56.31 -47.61 78.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.021 -0.536 . . . . 3.41 109.936 172.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.433 HG22 ' O ' ' A' ' 78' ' ' HIS . 9.0 tp -74.7 -27.35 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 120.647 -0.421 . . . . 1.83 110.606 178.452 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.602 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 28.5 m-70 -65.63 -26.03 67.64 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.087 0.47 . . . . 0.45 110.955 174.153 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 56.7 m . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 115.981 -0.554 . . . . 1.21 110.523 176.581 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.681 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 99.5 mt . . . . . 0 CA--C 1.513 -0.477 0 CA-C-O 120.631 0.253 . . . . 0.52 110.62 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 67' ' ' LYS . 5.5 tppp? -81.8 129.75 34.84 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.246 -0.434 . . . . 1.99 111.627 -172.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 19.5 t -82.5 128.77 34.6 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 108.688 -0.856 . . . . 0.46 108.688 169.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.511 ' HA ' ' NE ' ' A' ' 63' ' ' ARG . 1.2 mmp_? -71.14 -38.88 72.23 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.109 -0.496 . . . . 3.86 111.973 -172.217 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -90.46 -12.27 37.86 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.164 0.431 . . . . 2.18 112.164 -174.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.482 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 99.1 m -109.67 -41.72 4.48 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.652 -0.419 . . . . 0.32 111.703 178.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 96.19 1.3 61.12 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.513 -0.851 . . . . 0.4 111.698 -177.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.501 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 17.9 ptmt -88.28 -177.72 5.74 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 122.816 0.446 . . . . 1.28 110.126 179.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.681 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 57.3 mt-30 -145.14 144.11 30.72 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.733 -0.667 . . . . 1.77 111.405 -170.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.552 ' CD1' HD23 ' A' ' 75' ' ' LEU . 50.4 m-85 -123.1 135.92 54.58 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.162 -0.472 . . . . 0.87 111.454 -178.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.6 p -83.67 -4.52 58.67 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.256 -0.429 . . . . 1.77 111.448 -178.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.488 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 28.5 m -123.76 129.64 51.38 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.981 -0.554 . . . . 0.9 109.924 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.1 t -61.11 -52.89 62.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.416 -0.811 . . . . 1.42 111.579 -175.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.95 -29.22 71.89 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.883 -0.675 . . . . 0.32 112.424 179.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.488 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 0.9 OUTLIER -66.39 -37.74 85.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.565 0.221 . . . . 1.81 110.672 178.72 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.552 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.8 tm? -81.06 -32.01 34.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.373 -0.376 . . . . 0.38 110.299 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.564 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -67.39 -47.0 71.61 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.754 0.279 . . . . 1.93 111.754 179.148 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -31.74 73.09 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.9 0.857 . . . . 3.92 109.092 176.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . 0.422 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 72.7 t60 -65.29 -52.09 56.49 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.229 -1.35 . . . . 0.49 110.45 179.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.512 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 19.3 mt -76.28 -18.65 58.88 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.083 -0.508 . . . . 0.51 111.295 -179.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 24.5 ttt180 -55.44 -47.06 76.61 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.194 -0.669 . . . . 3.41 109.194 170.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 47.7 mm -61.8 -41.57 91.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.415 -0.812 . . . . 1.83 110.314 175.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.512 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 62.7 m-70 -70.12 -23.81 63.08 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.8 -0.637 . . . . 0.45 112.542 -177.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 22.2 m . . . . . 0 C--N 1.326 -0.426 0 CA-C-O 120.908 0.385 . . . . 1.21 111.062 -178.903 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.694 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 83.6 mt . . . . . 0 CA--C 1.516 -0.338 0 CA-C-O 120.676 0.274 . . . . 0.52 111.001 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.567 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 48.5 tptt -81.82 122.24 27.46 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.839 -0.619 . . . . 1.99 111.888 -171.062 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 42.3 t -91.73 96.9 10.68 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 107.406 -1.331 . . . . 0.46 107.406 169.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 63' ' ' ARG . 59.7 mtt85 -57.49 -30.94 65.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.07 0.462 . . . . 3.86 110.973 -177.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -69.18 -37.29 78.07 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.7 -0.682 . . . . 2.18 110.987 -176.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . 0.418 ' HB3' ' HD3' ' A' ' 67' ' ' LYS . 67.7 m -94.57 -42.13 8.97 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 121.639 0.733 . . . . 0.32 111.2 177.252 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.63 3.01 43.54 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-N 114.891 -1.05 . . . . 0.4 111.32 -177.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.418 ' HD3' ' HB3' ' A' ' 65' ' ' CYS . 18.1 pttt -108.36 -178.24 3.55 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-O 120.886 0.374 . . . . 1.28 110.07 -176.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.694 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 29.0 mt-30 -141.35 147.28 37.83 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.718 -0.674 . . . . 1.77 111.356 -168.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.468 ' CD1' HD23 ' A' ' 75' ' ' LEU . 54.1 m-85 -126.81 125.0 40.97 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.403 -0.362 . . . . 0.87 111.256 -176.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.7 p -68.42 -22.21 64.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.369 -0.378 . . . . 1.77 111.877 -176.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.01 129.28 48.26 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.227 0.537 . . . . 0.9 110.644 179.223 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.557 ' O ' ' HG2' ' A' ' 76' ' ' LYS . 40.7 t -65.59 -43.77 88.68 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.283 -0.871 . . . . 1.42 111.039 -176.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.44 ' O ' ' HG3' ' A' ' 77' ' ' ARG . . . -68.72 -33.35 75.69 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.901 -0.666 . . . . 0.32 111.983 179.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -57.68 -45.14 86.0 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.347 -0.612 . . . . 1.81 109.347 176.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.468 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.2 tm? -71.04 -31.25 67.66 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.702 -0.681 . . . . 0.38 110.379 179.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.557 ' HG2' ' O ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -65.04 -50.75 65.01 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.886 0.374 . . . . 1.93 109.999 176.851 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 73' ' ' GLY . 81.3 mtt180 -59.28 -39.19 82.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.673 0.749 . . . . 3.92 109.573 174.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -63.18 -36.92 85.22 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.625 -1.17 . . . . 0.49 111.45 -177.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.531 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 37.1 mt -85.74 -23.85 27.16 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 122.212 -0.305 . . . . 0.51 111.242 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 46.3 ttp180 -59.11 -38.64 80.04 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.924 -0.398 . . . . 3.41 109.924 173.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 17.2 tt -82.22 -26.15 9.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 C-N-CA 120.83 -0.348 . . . . 1.83 110.564 178.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.531 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 13.3 m-70 -66.29 -47.19 74.42 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.801 0.334 . . . . 0.45 110.842 175.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.4 m . . . . . 0 C--N 1.32 -0.7 0 CA-C-N 116.295 -0.411 . . . . 1.21 110.962 -179.131 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.473 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 62.1 mt . . . . . 0 CA--C 1.512 -0.506 0 CA-C-O 121.196 0.522 . . . . 0.52 111.397 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.9 tptm -82.04 129.59 34.84 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.3 -0.864 . . . . 1.99 110.572 -174.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 47.3 t -86.39 97.07 10.24 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 108.119 -1.067 . . . . 0.46 108.119 172.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 mtp180 -59.47 -23.77 63.01 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.721 0.296 . . . . 3.86 111.56 -175.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -84.56 -20.97 30.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.531 -0.304 . . . . 2.18 111.425 -178.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 55.4 m -107.2 -41.97 4.98 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.923 0.392 . . . . 0.32 111.769 178.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.72 -3.11 42.04 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.742 -0.742 . . . . 0.4 111.722 -179.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.42 -176.85 3.19 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 109.54 -0.541 . . . . 1.28 109.54 178.454 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -139.81 149.89 44.05 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 116.126 -0.488 . . . . 1.77 110.492 -162.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.489 ' CD1' HD23 ' A' ' 75' ' ' LEU . 55.7 m-85 -117.27 179.76 3.95 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 116.345 -0.389 . . . . 0.87 110.476 -179.299 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 25.4 p -129.54 17.83 5.84 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.129 0.49 . . . . 1.77 111.051 -179.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.631 ' HB ' ' CB ' ' A' ' 74' ' ' ASN . 22.7 m -141.97 129.46 21.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.92 -0.582 . . . . 0.9 109.767 -179.019 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.473 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 11.9 m -66.2 -42.08 89.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.644 -0.707 . . . . 1.42 111.296 -175.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.61 -35.42 59.21 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.449 -0.882 . . . . 0.32 111.953 177.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.631 ' CB ' ' HB ' ' A' ' 71' ' ' THR . 43.6 t-20 -58.59 -50.68 72.94 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.706 0.289 . . . . 1.81 110.319 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.489 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.2 tm? -75.41 -32.49 60.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.112 -0.495 . . . . 0.38 111.184 -175.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.61 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -69.7 -45.11 68.99 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.84 -0.744 . . . . 1.93 110.186 -178.575 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 9.7 tpp180 -62.7 -33.51 75.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.758 0.79 . . . . 3.92 109.414 174.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . 0.435 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 65.8 t60 -65.0 -39.0 92.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.421 -1.263 . . . . 0.49 110.706 177.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.505 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 54.3 mt -81.83 -23.63 36.32 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.534 -0.303 . . . . 0.51 111.808 -179.446 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -62.28 -40.09 95.1 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.678 -0.489 . . . . 3.41 109.678 173.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.5 tt -83.25 -10.82 11.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-O 121.07 0.462 . . . . 1.83 110.86 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.505 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 13.6 m-70 -86.35 -47.3 9.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.263 -0.426 . . . . 0.45 110.501 173.607 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.0 m . . . . . 0 C--N 1.322 -0.619 0 CA-C-N 116.034 -0.53 . . . . 1.21 111.056 -174.024 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 88.7 mt . . . . . 0 N--CA 1.452 -0.364 0 N-CA-C 110.309 -0.256 . . . . 0.52 110.309 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.929 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 24.4 mtmm -78.99 130.19 35.27 Favored 'General case' 0 CA--C 1.511 -0.529 0 C-N-CA 120.389 -0.524 . . . . 1.99 110.806 -175.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 35.7 t -68.35 110.29 4.03 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 108.593 -0.891 . . . . 0.46 108.593 170.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 ttp180 -57.93 -30.43 65.94 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 123.171 0.294 . . . . 3.86 111.741 -175.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -85.29 -26.78 26.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.57 -0.286 . . . . 2.18 111.663 -174.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 93.6 m -103.15 -40.24 6.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.968 0.413 . . . . 0.32 111.278 -178.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.75 -1.11 52.32 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 121.141 -0.552 . . . . 0.4 112.043 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.4 ' HE3' ' CE1' ' A' ' 78' ' ' HIS . 0.0 OUTLIER -108.95 129.86 55.44 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 122.129 0.966 . . . . 1.28 110.739 -179.802 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.929 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 3.8 pt20 -81.33 161.9 23.65 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 113.384 -1.735 . . . . 1.77 112.917 -176.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.586 ' CD1' HD23 ' A' ' 75' ' ' LEU . 34.1 m-85 -130.92 131.8 44.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.702 -1.136 . . . . 0.87 109.446 176.128 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.7 t -84.05 -4.53 58.82 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.005 0.431 . . . . 1.77 111.147 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.2 m -115.52 129.27 56.48 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.264 0.554 . . . . 0.9 110.201 179.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.8 p -65.65 -50.06 66.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.177 -0.919 . . . . 1.42 111.854 -175.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.65 -29.52 67.17 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.839 -0.696 . . . . 0.32 112.575 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.462 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 6.0 m120 -68.59 -55.02 12.98 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.327 0.108 . . . . 1.81 110.766 176.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.586 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.1 tm? -69.82 -32.23 70.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.624 -0.262 . . . . 0.38 111.123 -175.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 20.8 mmmt -67.68 -51.62 47.49 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.733 -0.387 . . . . 1.93 111.328 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -64.68 -29.13 70.12 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.592 0.71 . . . . 3.92 109.565 176.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . 0.462 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 53.3 t60 -64.44 -48.86 73.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.972 -1.013 . . . . 0.49 110.587 177.005 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.497 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 33.1 mt -79.49 -19.55 49.44 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.723 0.296 . . . . 0.51 111.04 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 -58.54 -48.68 80.06 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.062 -0.517 . . . . 3.41 110.385 175.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.0 tt -72.3 -30.14 34.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.459 -0.337 . . . . 1.83 110.326 178.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . 0.497 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 33.4 m-70 -64.21 -41.24 97.13 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.104 0.478 . . . . 0.45 110.791 174.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 115.965 -0.561 . . . . 1.21 110.589 179.954 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.598 ' N ' ' HG1' ' A' ' 70' ' ' THR . . . . . . . . 0 N--CA 1.481 1.649 0 CA-C-O 119.818 -0.434 . . . . 1.54 112.183 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.718 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 78.9 Cg_exo -42.94 115.09 0.5 Allowed 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 123.008 2.472 . . . . 1.27 112.828 173.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 95.5 mt -118.48 104.55 10.8 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.812 -1.085 . . . . 0.52 110.821 176.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.406 ' HD3' ' O ' ' A' ' 67' ' ' LYS . 15.2 tppt? -81.77 128.75 34.32 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.489 -0.778 . . . . 1.99 110.865 -174.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 43.2 t -91.47 101.91 14.58 Favored 'General case' 0 N--CA 1.439 -0.989 0 N-CA-C 108.617 -0.883 . . . . 0.46 108.617 171.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -55.75 -31.92 62.97 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.602 0.564 . . . . 3.86 111.131 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 31.7 mm-40 -73.14 -45.53 56.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.004 -0.544 . . . . 2.18 111.479 -177.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.565 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 65.9 m -86.63 -41.08 14.53 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.381 0.61 . . . . 0.32 110.712 -176.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.68 -0.56 52.61 Favored Glycine 0 N--CA 1.443 -0.891 0 N-CA-C 110.657 -0.977 . . . . 0.4 110.657 -176.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.565 ' HG2' ' HB2' ' A' ' 65' ' ' CYS . 18.4 ptmt -92.17 -177.66 4.74 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.067 -0.567 . . . . 1.28 109.894 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.481 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 36.1 tt0 -156.72 137.1 12.97 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.603 -0.726 . . . . 1.77 110.463 -171.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.718 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 62.3 m-85 -109.96 -174.69 2.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.226 -0.443 . . . . 0.87 110.132 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.598 ' HG1' ' N ' ' A' ' 58' ' ' GLY . 14.4 t -140.86 17.41 2.31 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.757 0.789 . . . . 1.77 108.948 170.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 16.9 m -131.89 128.69 39.11 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.142 -0.936 . . . . 0.9 109.555 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.9 t -65.03 -52.37 56.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.982 -1.008 . . . . 1.42 112.229 -172.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.57 -40.59 98.05 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.979 -0.629 . . . . 0.32 112.899 -176.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -63.65 -47.19 82.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.618 0.209 . . . . 1.81 111.455 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.543 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.8 tm? -72.47 -35.72 68.28 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.263 -0.273 . . . . 0.38 110.263 -178.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.1 mmmt -62.6 -52.72 62.26 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.956 -0.298 . . . . 1.93 110.958 177.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -61.43 -32.36 72.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.22 0.533 . . . . 3.92 110.215 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -65.57 -45.64 82.55 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.394 -0.821 . . . . 0.49 110.764 178.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.548 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 23.4 mt -79.77 -19.16 49.33 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.923 0.392 . . . . 0.51 110.644 -179.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.437 ' HG3' ' O ' ' A' ' 85' ' ' GLU . 32.4 ttt180 -58.8 -47.55 84.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.919 -0.582 . . . . 3.41 109.556 173.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 65.4 mt -64.1 -41.28 91.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.511 -0.768 . . . . 1.83 110.132 176.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.548 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 36.3 m-70 -60.31 -40.35 90.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.641 -0.708 . . . . 0.45 111.741 178.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 28.4 m -84.82 -29.9 24.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.338 -0.392 . . . . 1.21 111.572 -176.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 83.95 5.81 87.38 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.947 -0.644 . . . . 1.25 111.527 -176.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.437 ' O ' ' HG3' ' A' ' 80' ' ' ARG . 6.2 mm-40 -107.35 -171.78 1.95 Allowed 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 122.584 0.354 . . . . 3.18 110.959 -177.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.573 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 6.8 mptt . . . . . 0 C--O 1.248 0.976 0 CA-C-O 118.803 -0.618 . . . . 6.25 109.801 -175.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.677 0 N-CA-C 111.902 -0.479 . . . . 1.54 111.902 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.672 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 88.3 Cg_exo -41.7 115.21 0.41 Allowed 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 123.423 2.749 . . . . 1.27 113.255 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.524 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 79.6 mt -121.94 116.07 23.7 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.759 -1.109 . . . . 0.52 110.604 175.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.409 ' HD2' ' O ' ' A' ' 67' ' ' LYS . 21.5 tptm -82.11 128.85 34.54 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.552 -0.749 . . . . 1.99 111.279 -171.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 54.1 t -89.76 106.5 18.51 Favored 'General case' 0 N--CA 1.436 -1.156 0 N-CA-C 107.715 -1.217 . . . . 0.46 107.715 171.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.4 mtm180 -64.13 -35.88 82.2 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.373 0.606 . . . . 3.86 110.013 -175.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -68.02 -36.01 79.25 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.931 -1.031 . . . . 2.18 111.381 -177.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 90.4 m -97.44 -42.07 7.9 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.088 0.471 . . . . 0.32 111.834 -178.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 102.98 4.52 48.05 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 121.021 -0.609 . . . . 0.4 111.622 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.409 ' O ' ' HD2' ' A' ' 61' ' ' LYS . 17.0 ptmt -103.92 -176.28 3.04 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 123.273 0.629 . . . . 1.28 109.354 179.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.461 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 17.2 pt20 -148.4 151.86 35.99 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 120.799 0.333 . . . . 1.77 111.247 -174.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.672 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 58.8 m-85 -117.58 176.18 5.29 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 116.166 -0.47 . . . . 0.87 110.412 -176.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 76.3 p -112.81 -21.23 11.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.889 0.376 . . . . 1.77 111.535 -177.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.6 p -112.22 134.16 53.93 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.409 0.623 . . . . 0.9 111.389 -175.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.524 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 23.3 m -64.01 -46.39 84.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.946 -1.025 . . . . 1.42 111.891 -175.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.9 -35.2 78.76 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.43 -0.89 . . . . 0.32 112.341 -177.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -68.48 -42.68 78.33 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.629 0.252 . . . . 1.81 110.693 -176.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.54 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.4 tm? -72.51 -41.29 66.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.516 -0.311 . . . . 0.38 110.825 -179.27 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.51 -41.84 79.4 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.269 -0.572 . . . . 1.93 110.766 -177.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -62.15 -36.54 82.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.222 0.534 . . . . 3.92 109.788 172.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.416 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 82.0 t60 -63.26 -47.84 80.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.376 -0.829 . . . . 0.49 111.034 177.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.484 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 35.0 mt -73.29 -19.6 61.01 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 121.197 -0.201 . . . . 0.51 111.328 -177.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.488 ' HG3' ' O ' ' A' ' 85' ' ' GLU . 73.9 ttt180 -64.91 -38.71 91.86 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.188 -0.671 . . . . 3.41 109.188 171.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 54.8 mt -66.08 -37.14 79.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.854 -0.612 . . . . 1.83 109.64 176.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.484 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 21.6 m-70 -67.51 -33.76 75.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.449 -0.796 . . . . 0.45 111.658 178.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 29.2 t -90.91 -55.2 3.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.873 0.368 . . . . 1.21 111.554 -177.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 106.08 -20.44 35.73 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 111.317 -0.713 . . . . 1.25 111.317 -173.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.488 ' O ' ' HG3' ' A' ' 80' ' ' ARG . 6.2 mm-40 -82.89 154.57 24.54 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.785 0.802 . . . . 3.18 111.157 -177.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.307 -1.265 0 CA-C-N 114.417 -1.265 . . . . 6.25 110.956 -172.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.792 0 CA-C-O 119.575 -0.569 . . . . 1.54 112.027 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.99 117.94 4.65 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 122.334 2.023 . . . . 1.27 112.177 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 72' ' ' SER . 59.7 mt -117.84 129.03 55.41 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.366 -0.834 . . . . 0.52 110.816 176.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -82.14 131.38 35.24 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.429 -0.805 . . . . 1.99 111.758 -170.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 48.6 t -97.38 118.2 33.32 Favored 'General case' 0 N--CA 1.438 -1.057 0 N-CA-C 107.795 -1.187 . . . . 0.46 107.795 169.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.48 ' H ' ' HD3' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -73.35 -40.45 64.41 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.199 0.523 . . . . 3.86 110.141 -174.335 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -66.43 -36.59 83.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.133 -0.939 . . . . 2.18 110.798 -176.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 94.2 m -92.6 -41.18 10.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.101 -0.499 . . . . 0.32 110.987 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.56 9.89 54.22 Favored Glycine 0 N--CA 1.451 -0.315 0 N-CA-C 111.409 -0.676 . . . . 0.4 111.409 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -110.63 -176.25 2.93 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 123.574 0.75 . . . . 1.28 109.532 -178.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.49 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 3.8 pt20 -138.9 156.23 47.44 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 116.012 -0.54 . . . . 1.77 110.887 -177.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.646 ' CD1' HD23 ' A' ' 75' ' ' LEU . 40.1 m-85 -122.04 128.62 51.61 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.165 -0.47 . . . . 0.87 111.106 -178.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.8 t -69.23 -14.93 63.24 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.977 -0.556 . . . . 1.77 111.689 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 24.4 m -112.8 129.05 56.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.037 0.446 . . . . 0.9 110.274 -178.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.518 ' HA ' HD12 ' A' ' 60' ' ' LEU . 7.8 m -69.31 -53.63 18.72 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.401 -0.818 . . . . 1.42 112.333 -172.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.57 -27.87 73.54 Favored Glycine 0 CA--C 1.508 -0.366 0 C-N-CA 120.697 -0.763 . . . . 0.32 112.0 -178.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -66.47 -44.53 82.46 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.855 -0.424 . . . . 1.81 109.855 178.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.646 HD23 ' CD1' ' A' ' 69' ' ' PHE . 2.5 tm? -67.7 -39.97 84.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.134 -0.484 . . . . 0.38 110.067 178.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.564 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 3.5 mmpt? -61.9 -43.3 99.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.873 0.368 . . . . 1.93 110.829 177.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.461 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 41.6 ttm180 -66.57 -38.82 87.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.164 -0.471 . . . . 3.92 110.58 175.157 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -64.02 -47.27 80.92 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.879 -0.601 . . . . 0.49 111.433 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.579 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 18.5 mt -75.09 -19.77 59.8 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 121.056 -0.257 . . . . 0.51 110.967 -178.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.461 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 0.3 OUTLIER -57.48 -46.13 84.04 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.938 -0.764 . . . . 3.41 108.938 170.556 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 52.3 mt -68.18 -38.09 79.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.351 -0.84 . . . . 1.83 110.545 178.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.579 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 16.5 m-70 -61.84 -31.22 71.45 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.282 -0.417 . . . . 0.45 111.311 177.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.1 m -80.09 -16.91 53.99 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.083 -0.508 . . . . 1.21 111.157 -178.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 75.84 15.81 81.08 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.965 -0.636 . . . . 1.25 112.125 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -114.1 138.56 50.25 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 109.955 -0.387 . . . . 3.18 109.955 -177.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.52 -0.752 . . . . 6.25 109.616 176.734 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.757 0 N-CA-C 112.094 -0.402 . . . . 1.54 112.094 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.851 ' HB2' HE21 ' A' ' 68' ' ' GLN . 29.0 Cg_endo -64.3 118.0 4.99 Favored 'Trans proline' 0 N--CA 1.454 -0.844 0 C-N-CA 121.882 1.721 . . . . 1.27 110.603 170.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.63 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 75.0 mt -100.81 126.5 47.39 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.258 -0.883 . . . . 0.52 111.568 -175.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 36.4 tptt -81.59 117.53 22.04 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.727 -0.669 . . . . 1.99 110.929 -172.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 40.4 t -78.57 112.67 15.88 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.086 -0.709 . . . . 0.46 109.086 174.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 63.8 ttt180 -59.95 -36.99 78.25 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.054 -0.521 . . . . 3.86 111.43 -177.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.3 mp0 -76.52 -36.01 57.97 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.029 -0.532 . . . . 2.18 111.79 -176.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.479 ' HB3' ' HD3' ' A' ' 67' ' ' LYS . 80.1 m -93.34 -41.34 9.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.099 0.476 . . . . 0.32 111.584 -177.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.8 -0.75 59.43 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.539 -0.755 . . . . 0.4 111.617 -176.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.479 ' HD3' ' HB3' ' A' ' 65' ' ' CYS . 12.2 pttt -103.72 -177.78 3.47 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 108.762 -0.829 . . . . 1.28 108.762 178.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.851 HE21 ' HB2' ' A' ' 59' ' ' PRO . 13.4 pt20 -145.67 156.5 43.68 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 116.484 -0.325 . . . . 1.77 111.327 -170.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.602 ' CD2' HD23 ' A' ' 75' ' ' LEU . 43.6 m-85 -131.03 137.82 49.35 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-N 116.03 -0.532 . . . . 0.87 111.416 -170.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.9 m -72.6 -32.69 66.17 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.48 -0.782 . . . . 1.77 112.011 -173.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.52 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 24.9 m -100.97 128.84 46.82 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.392 0.615 . . . . 0.9 110.379 -179.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.565 ' HA ' HD12 ' A' ' 60' ' ' LEU . 22.9 t -64.95 -44.71 88.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.211 -0.904 . . . . 1.42 110.964 -176.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.53 -31.11 79.12 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.842 -0.694 . . . . 0.32 112.088 177.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.52 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 5.2 t30 -67.75 -45.58 74.56 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.78 -0.452 . . . . 1.81 109.78 178.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.602 HD23 ' CD2' ' A' ' 69' ' ' PHE . 1.5 tm? -68.63 -35.35 77.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.003 -0.544 . . . . 0.38 109.698 178.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.578 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.5 OUTLIER -63.15 -47.83 81.06 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.891 -0.411 . . . . 1.93 109.891 177.861 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.493 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 7.8 tpt180 -63.69 -38.7 92.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.29 0.567 . . . . 3.92 110.355 175.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -61.48 -41.88 97.94 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.475 -0.784 . . . . 0.49 110.502 177.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 31.6 mt -75.85 -19.56 58.8 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.27 -0.423 . . . . 0.51 111.349 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.493 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 27.3 ttt85 -61.05 -44.07 97.93 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.587 -0.523 . . . . 3.41 109.587 173.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 48.2 mm -61.3 -46.19 97.11 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.527 -0.761 . . . . 1.83 110.086 175.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -58.26 -43.03 87.69 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.671 -0.695 . . . . 0.45 111.436 177.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.442 ' HB2' ' HG2' ' A' ' 85' ' ' GLU . 24.2 m -73.14 -31.97 64.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.144 -0.48 . . . . 1.21 111.601 -177.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 88.44 27.01 26.24 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.673 -0.775 . . . . 1.25 111.587 -178.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.455 ' HB2' ' HG3' ' A' ' 80' ' ' ARG . 48.1 mm-40 -82.47 127.85 33.7 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.027 0.441 . . . . 3.18 110.583 -177.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.1 pttm . . . . . 0 C--O 1.248 1.001 0 CA-C-N 115.511 -0.768 . . . . 6.25 109.927 173.609 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.57 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . . . . . . 0 N--CA 1.48 1.593 0 N-CA-C 111.663 -0.575 . . . . 1.54 111.663 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.706 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 74.8 Cg_exo -42.22 115.13 0.44 Allowed 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 123.266 2.644 . . . . 1.27 112.814 177.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 58' ' ' GLY . 97.6 mt -128.9 116.55 19.58 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.868 -1.06 . . . . 0.52 111.35 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.6 tptp -81.47 132.68 35.33 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.835 -0.621 . . . . 1.99 111.112 -172.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 53.2 t -93.91 116.64 29.11 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.062 -1.088 . . . . 0.46 108.062 171.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 46.9 mtp180 -71.9 -37.33 70.13 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.992 0.425 . . . . 3.86 111.143 -176.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.456 ' OE2' ' HB3' ' A' ' 82' ' ' HIS . 4.5 mp0 -65.6 -35.34 80.53 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.887 -0.597 . . . . 2.18 111.734 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.42 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 85.8 m -98.42 -40.5 8.25 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.948 0.404 . . . . 0.32 111.512 -178.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 103.7 -6.52 48.71 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 111.442 -0.663 . . . . 0.4 111.442 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.601 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 17.7 ptmt -90.37 -176.35 4.77 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.058 -0.571 . . . . 1.28 110.438 -177.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -143.18 141.43 31.14 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.369 -0.832 . . . . 1.77 109.905 -172.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.706 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 6.6 m-85 -108.53 174.12 6.01 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 110.214 -0.291 . . . . 0.87 110.214 -177.007 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 64.8 p -119.65 -31.74 4.48 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.976 0.417 . . . . 1.77 110.812 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.1 p -97.71 129.34 44.76 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.507 0.67 . . . . 0.9 110.815 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.49 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 20.2 p -64.87 -42.84 94.51 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.143 -0.935 . . . . 1.42 112.023 -173.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.08 -32.55 76.94 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.551 -0.833 . . . . 0.32 112.003 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -67.6 -43.65 80.01 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 121.315 -0.154 . . . . 1.81 111.005 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.526 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.5 tm? -74.28 -35.17 63.74 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 121.04 -0.264 . . . . 0.38 110.429 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.558 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -60.5 -55.05 38.11 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.473 0.178 . . . . 1.93 111.309 178.384 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 -62.57 -30.7 71.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.289 0.566 . . . . 3.92 110.045 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -69.21 -43.1 74.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.331 -0.85 . . . . 0.49 111.751 -178.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.508 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 18.0 mt -79.15 -23.87 43.69 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.179 -0.609 . . . . 0.51 110.801 -178.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.689 ' HG3' ' HB3' ' A' ' 85' ' ' GLU . 77.5 ttt180 -58.27 -47.66 82.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.091 -0.504 . . . . 3.41 110.324 173.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.7 tt -73.36 -32.47 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-O 120.688 0.28 . . . . 1.83 110.682 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.508 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 6.7 m-70 -58.17 -49.86 75.55 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.061 0.458 . . . . 0.45 110.646 174.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 24.1 m -79.06 -11.12 59.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.854 -0.612 . . . . 1.21 111.58 -178.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.41 31.25 55.1 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.892 -0.67 . . . . 1.25 112.18 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.689 ' HB3' ' HG3' ' A' ' 80' ' ' ARG . 34.5 tt0 -74.66 105.81 5.93 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 121.157 0.503 . . . . 3.18 109.919 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.405 ' NZ ' ' HB2' ' A' ' 86' ' ' LYS . 8.3 mtmp? . . . . . 0 C--O 1.248 1.006 0 CA-C-N 115.462 -0.79 . . . . 6.25 110.314 -176.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.43 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . . . . . . 0 N--CA 1.482 1.711 0 CA-C-O 119.347 -0.696 . . . . 1.54 111.639 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -49.71 115.08 1.62 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.608 2.205 . . . . 1.27 111.762 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.584 HD12 ' HA ' ' A' ' 72' ' ' SER . 36.4 mt -118.72 109.86 16.59 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.172 -0.922 . . . . 0.52 110.961 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.678 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 71.5 tttt -81.2 120.69 25.2 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.132 -0.486 . . . . 1.99 110.913 -175.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 16.9 t -69.18 127.98 35.02 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 109.171 -0.677 . . . . 0.46 109.171 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 36.2 ttt-85 -66.52 -47.34 73.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.956 -0.566 . . . . 3.86 111.345 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.2 mp0 -72.37 -39.53 67.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.16 -0.473 . . . . 2.18 111.77 -174.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.459 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 89.3 m -88.82 -40.52 13.1 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.2 0.524 . . . . 0.32 110.651 -177.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 93.77 8.48 60.65 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 115.213 -0.903 . . . . 0.4 111.381 -174.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.459 ' HG2' ' HB2' ' A' ' 65' ' ' CYS . 0.0 OUTLIER -109.41 129.76 55.53 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 122.04 0.924 . . . . 1.28 110.829 -175.727 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.678 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 14.5 mt-30 -86.62 147.78 25.76 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 113.826 -1.534 . . . . 1.77 112.218 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.569 ' CD1' HD23 ' A' ' 75' ' ' LEU . 24.8 m-85 -118.31 127.35 53.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.398 -0.819 . . . . 0.87 110.077 177.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.7 t -74.22 -18.78 60.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.812 0.339 . . . . 1.77 110.656 -178.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.8 m -101.74 127.94 48.28 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.538 -0.541 . . . . 0.9 109.538 176.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.584 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.1 m -70.52 -44.12 68.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.73 -0.668 . . . . 1.42 111.756 -172.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.519 ' O ' ' HG2' ' A' ' 77' ' ' ARG . . . -65.26 -36.73 93.15 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.567 -0.825 . . . . 0.32 112.234 178.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.7 -48.8 78.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.706 0.289 . . . . 1.81 110.407 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.569 HD23 ' CD1' ' A' ' 69' ' ' PHE . 2.2 tm? -67.31 -35.27 79.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.085 -0.507 . . . . 0.38 110.369 -179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.604 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -65.89 -45.42 82.1 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 110.234 -0.284 . . . . 1.93 110.234 179.787 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.672 ' O ' ' HG2' ' A' ' 80' ' ' ARG . 23.7 mmt180 -62.35 -41.83 98.9 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.493 0.663 . . . . 3.92 109.515 173.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 81.5 t60 -58.27 -44.82 88.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.026 -0.988 . . . . 0.49 111.463 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.464 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 18.7 mt -79.61 -25.91 41.35 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.417 0.525 . . . . 0.51 112.417 -176.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.672 ' HG2' ' O ' ' A' ' 77' ' ' ARG . 12.5 ptm180 -70.24 -18.7 63.15 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.204 -0.598 . . . . 3.41 109.461 177.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.541 HG12 ' O ' ' A' ' 77' ' ' ARG . 41.0 mm -81.12 -32.45 12.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.124 -0.695 . . . . 1.83 109.124 171.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.464 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 20.6 m-70 -68.83 -41.2 78.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.077 -0.965 . . . . 0.45 111.33 178.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.3 p -82.95 -26.69 31.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.068 0.461 . . . . 1.21 111.091 178.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 93.36 8.24 61.38 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.91 -0.662 . . . . 1.25 111.854 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -81.64 92.82 6.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.155 0.502 . . . . 3.18 110.83 -178.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.604 -0.712 . . . . 6.25 109.454 175.383 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.433 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . . . . . . 0 N--CA 1.48 1.617 0 CA-C-O 119.637 -0.535 . . . . 1.54 112.273 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.506 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 62.5 Cg_exo -35.76 116.11 0.12 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 124.259 3.306 . . . . 1.27 113.948 -178.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.519 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 83.6 mt -121.27 105.19 10.33 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.719 -1.128 . . . . 0.52 110.557 175.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 44.9 tptt -82.26 127.88 33.63 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.19 -0.914 . . . . 1.99 111.481 -172.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 52.5 t -88.48 106.9 18.58 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 108.578 -0.897 . . . . 0.46 108.578 170.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -63.01 -30.11 71.35 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.133 -0.485 . . . . 3.86 111.648 -174.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -85.32 -26.28 26.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.301 -0.409 . . . . 2.18 111.461 -174.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 79.8 m -99.68 -42.58 6.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.04 0.447 . . . . 0.32 111.666 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.36 -10.04 42.52 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.269 -0.732 . . . . 0.4 111.269 -176.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.512 ' HE3' ' CZ ' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -81.22 -178.11 6.77 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 121.088 0.47 . . . . 1.28 110.099 179.834 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.504 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 27.7 tt0 -160.34 141.22 11.99 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 115.311 -0.859 . . . . 1.77 110.378 -172.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.512 ' CZ ' ' HE3' ' A' ' 67' ' ' LYS . 96.1 m-85 -118.41 172.65 7.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.853 0.358 . . . . 0.87 111.425 -175.011 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.2 t -119.46 -10.53 9.65 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.549 0.69 . . . . 1.77 109.243 172.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 22.8 m -99.13 128.84 45.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.734 -0.667 . . . . 0.9 110.031 177.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.519 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 14.0 m -70.61 -51.13 30.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.611 -0.722 . . . . 1.42 111.419 -174.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.414 ' O ' ' HG3' ' A' ' 77' ' ' ARG . . . -62.33 -33.95 87.74 Favored Glycine 0 CA--C 1.51 -0.276 0 C-N-CA 120.867 -0.682 . . . . 0.32 112.631 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -60.8 -54.48 44.64 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.908 -0.404 . . . . 1.81 109.908 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.461 ' HG ' ' HB3' ' A' ' 60' ' ' LEU . 1.5 tm? -70.21 -32.14 69.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.842 0.353 . . . . 0.38 110.923 -177.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.449 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -66.64 -44.98 80.5 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.411 -0.516 . . . . 1.93 110.6 -178.741 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.414 ' HG3' ' O ' ' A' ' 73' ' ' GLY . 24.4 mtm-85 -69.4 -33.07 72.45 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.462 0.649 . . . . 3.92 109.823 175.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.402 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 56.6 t60 -58.5 -51.63 69.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.961 -1.018 . . . . 0.49 110.465 176.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.565 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 32.8 mt -75.57 -18.92 59.61 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.177 -0.465 . . . . 0.51 111.109 178.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.496 ' HA ' ' HG2' ' A' ' 85' ' ' GLU . 49.8 ttp180 -58.01 -48.29 80.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.308 -0.405 . . . . 3.41 109.966 177.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 38.5 pt -77.22 -25.4 15.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 1.83 110.981 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.565 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 21.9 m-70 -65.44 -47.31 76.61 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.831 0.348 . . . . 0.45 111.195 176.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.2 m -89.6 -23.82 21.85 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.233 -0.44 . . . . 1.21 111.405 -177.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 81.98 26.13 50.15 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.886 -0.673 . . . . 1.25 111.931 -178.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.496 ' HG2' ' HA ' ' A' ' 80' ' ' ARG . 7.6 pt-20 -74.57 115.61 14.32 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.274 0.559 . . . . 3.18 111.697 -174.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 60.5 mttp . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.54 -0.743 . . . . 6.25 109.546 172.188 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.666 0 CA-C-O 119.761 -0.466 . . . . 1.54 112.232 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.701 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 9.6 Cg_endo -50.79 116.04 2.36 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 123.001 2.467 . . . . 1.27 112.594 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 87.9 mt -132.01 120.79 22.91 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.862 -1.063 . . . . 0.52 111.144 176.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.651 ' HD2' ' HB3' ' A' ' 68' ' ' GLN . 2.5 mptm? -80.39 129.95 34.85 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.324 -0.398 . . . . 1.99 111.053 -176.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 37.1 t -75.33 114.55 13.99 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.711 -0.848 . . . . 0.46 108.711 170.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 63' ' ' ARG . 23.7 ttt180 -53.73 -46.13 70.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.402 -0.817 . . . . 3.86 112.119 -176.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 30.1 mp0 -75.87 -31.36 59.23 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.106 -0.497 . . . . 2.18 112.009 -174.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 91.6 m -98.27 -40.47 8.33 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.231 0.456 . . . . 0.32 112.231 -174.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 100.43 -0.92 55.75 Favored Glycine 0 N--CA 1.455 -0.098 0 C-N-CA 120.874 -0.679 . . . . 0.4 111.824 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -93.1 -175.7 3.94 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 109.303 -0.629 . . . . 1.28 109.303 179.171 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.651 ' HB3' ' HD2' ' A' ' 61' ' ' LYS . 20.6 pt20 -141.38 150.21 42.11 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.001 0.429 . . . . 1.77 111.703 -171.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.701 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 58.6 m-85 -118.94 177.42 4.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.827 -0.624 . . . . 0.87 109.825 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.4 p -120.26 0.35 10.61 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.171 0.51 . . . . 1.77 111.146 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.652 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 8.3 m -126.71 130.02 49.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.876 -0.602 . . . . 0.9 110.163 -175.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.419 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 49.6 m -63.23 -51.25 67.0 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.597 -0.729 . . . . 1.42 111.646 -177.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.4 -28.6 73.16 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.854 -0.689 . . . . 0.32 111.873 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.652 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 41.3 t-20 -64.58 -50.67 66.33 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.705 -0.48 . . . . 1.81 109.705 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.556 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.3 tm? -65.78 -38.87 90.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.31 -0.405 . . . . 0.38 110.377 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.8 mmmt -66.04 -47.9 72.86 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.831 -0.348 . . . . 1.93 111.18 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.412 ' O ' HG13 ' A' ' 81' ' ' ILE . 42.8 ttm180 -60.06 -41.57 92.65 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.234 0.54 . . . . 3.92 109.829 175.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -59.97 -45.03 94.02 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.135 -0.939 . . . . 0.49 111.273 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.617 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 34.1 mt -78.04 -19.54 54.13 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.666 -0.414 . . . . 0.51 110.952 -176.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -69.58 -33.08 72.21 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.03 -0.73 . . . . 3.41 109.03 172.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 77' ' ' ARG . 70.7 mt -75.67 -32.06 23.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.392 -0.822 . . . . 1.83 110.024 174.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.617 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 6.1 m-70 -65.53 -37.54 87.03 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.166 -0.47 . . . . 0.45 111.375 176.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 51.8 p -83.77 -28.44 28.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.085 0.469 . . . . 1.21 110.68 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 92.77 15.97 50.4 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.842 -0.694 . . . . 1.25 112.141 177.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -80.36 123.4 27.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.056 0.455 . . . . 3.18 110.496 -178.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 49.9 tttp . . . . . 0 C--O 1.246 0.902 0 CA-C-N 115.393 -0.821 . . . . 6.25 110.265 -179.306 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.597 0 CA-C-O 119.593 -0.559 . . . . 1.54 112.082 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_exo -38.75 117.73 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 124.035 3.157 . . . . 1.27 114.635 -177.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.471 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 95.8 mt -121.0 92.59 3.79 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.116 -1.402 . . . . 0.52 108.299 171.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.762 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 51.8 tttp -80.63 126.23 31.0 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.462 0.649 . . . . 1.99 112.501 -162.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 51.2 t -82.32 105.58 13.51 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 115.141 -0.936 . . . . 0.46 108.514 174.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 50.7 ttp180 -62.91 -29.31 70.68 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.776 0.322 . . . . 3.86 111.198 -176.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -79.4 -30.86 42.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 111.91 0.337 . . . . 2.18 111.91 -176.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 67.0 m -94.91 -41.94 8.93 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.461 0.648 . . . . 0.32 110.679 176.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 109.05 -12.1 34.26 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.092 -0.958 . . . . 0.4 111.437 -177.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.573 ' O ' ' HD2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -110.83 128.78 55.9 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 122.399 1.095 . . . . 1.28 111.451 -177.048 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.762 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -78.73 164.34 24.65 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 113.333 -1.758 . . . . 1.77 112.75 174.781 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -122.25 143.71 49.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.973 -1.012 . . . . 0.87 110.356 176.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.0 t -91.65 7.03 43.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.075 0.464 . . . . 1.77 110.735 177.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.452 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 3.9 m -126.22 129.57 49.23 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.735 -0.468 . . . . 0.9 109.735 179.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.471 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 22.8 t -69.51 -50.76 42.13 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.621 -0.718 . . . . 1.42 111.733 -172.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.2 -34.94 90.74 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.51 -0.852 . . . . 0.32 111.833 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.452 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 4.7 m-20 -62.11 -50.75 70.67 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.576 -0.157 . . . . 1.81 110.576 178.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.453 ' O ' HD22 ' A' ' 75' ' ' LEU . 0.6 OUTLIER -68.97 -37.01 78.54 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 123.162 0.288 . . . . 0.38 110.796 -177.489 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.556 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -62.44 -52.26 64.24 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.67 -0.412 . . . . 1.93 110.47 178.272 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 77' ' ' ARG . 27.9 mtp180 -62.94 -30.4 71.53 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.427 0.632 . . . . 3.92 110.414 176.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.444 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 69.8 t60 -66.32 -50.81 62.35 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.946 -1.024 . . . . 0.49 110.695 178.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.557 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 42.8 mt -75.92 -19.73 58.55 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.769 0.319 . . . . 0.51 110.807 179.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -58.93 -49.58 77.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.96 -0.564 . . . . 3.41 109.798 176.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.0 tp -73.78 -30.38 28.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.037 -0.529 . . . . 1.83 110.47 179.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.557 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 22.9 m-70 -61.84 -46.44 89.44 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.698 0.285 . . . . 0.45 111.109 176.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 9.3 m -80.73 -13.91 58.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.027 -0.533 . . . . 1.21 111.252 -176.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.69 29.38 57.74 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.987 -0.625 . . . . 1.25 112.17 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -104.32 152.4 22.29 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 121.16 0.505 . . . . 3.18 109.774 -177.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt . . . . . 0 C--N 1.31 -1.135 0 CA-C-N 115.335 -0.848 . . . . 6.25 110.442 -179.171 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.583 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . . . . . . 0 N--CA 1.483 1.781 0 CA-C-O 119.31 -0.717 . . . . 1.54 111.948 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.63 ' HB3' ' NE2' ' A' ' 68' ' ' GLN . 59.5 Cg_exo -40.36 115.83 0.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 123.003 2.469 . . . . 1.27 112.825 176.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 58' ' ' GLY . 96.6 mt -113.67 110.72 20.66 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.497 -0.774 . . . . 0.52 111.167 -179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 45.5 tptt -81.92 114.03 20.24 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.325 -0.852 . . . . 1.99 109.89 -176.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 41.8 t -70.75 109.53 5.01 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.43 -0.582 . . . . 0.46 109.43 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -58.41 -27.3 64.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.802 -0.636 . . . . 3.86 111.483 -177.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -93.43 -20.05 20.69 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.747 0.647 . . . . 2.18 112.747 -175.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.446 ' HB3' ' HG3' ' A' ' 67' ' ' LYS . 64.4 m -105.87 -41.37 5.43 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.211 0.448 . . . . 0.32 112.211 178.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.91 -0.08 59.02 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.44 -0.886 . . . . 0.4 111.565 -175.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.446 ' HG3' ' HB3' ' A' ' 65' ' ' CYS . 0.0 OUTLIER -108.09 -178.36 3.59 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 109.182 -0.673 . . . . 1.28 109.182 176.104 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.63 ' NE2' ' HB3' ' A' ' 59' ' ' PRO . 27.6 tt0 -141.68 148.92 39.88 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 111.763 0.283 . . . . 1.77 111.763 -159.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.468 ' CD1' HD23 ' A' ' 75' ' ' LEU . 66.5 m-85 -126.19 140.52 52.49 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 120.815 0.341 . . . . 0.87 111.229 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.2 p -84.72 -22.25 29.8 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.281 -0.418 . . . . 1.77 111.406 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 4.6 m -104.72 129.9 52.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.853 -0.612 . . . . 0.9 110.411 -177.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.419 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 14.6 m -60.59 -47.87 84.28 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.343 -0.844 . . . . 1.42 111.857 -176.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.25 -32.97 85.95 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.934 -0.65 . . . . 0.32 112.431 -179.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.441 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 5.4 m-20 -62.24 -46.36 89.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.537 0.208 . . . . 1.81 110.873 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.468 HD23 ' CD1' ' A' ' 69' ' ' PHE . 2.1 tm? -77.18 -31.8 55.65 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.545 -0.298 . . . . 0.38 110.592 -177.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.515 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -67.21 -44.95 78.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.659 0.266 . . . . 1.93 110.955 177.817 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.463 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 70.7 ttt180 -66.07 -34.61 78.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.579 0.704 . . . . 3.92 109.771 174.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.475 ' O ' HG22 ' A' ' 81' ' ' ILE . 77.6 t60 -65.83 -46.28 79.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.976 -1.011 . . . . 0.49 110.689 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.532 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 31.3 mt -74.27 -19.44 60.49 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.674 0.274 . . . . 0.51 110.803 177.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.463 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 70.4 ttt180 -60.32 -47.74 84.75 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.282 -0.417 . . . . 3.41 109.955 176.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.475 HG22 ' O ' ' A' ' 78' ' ' HIS . 11.3 tp -72.88 -25.83 22.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.303 -0.408 . . . . 1.83 110.36 177.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.532 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 32.3 m-70 -67.63 -41.44 83.91 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.048 0.452 . . . . 0.45 110.683 175.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.0 m -76.6 -24.26 53.45 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.138 0.494 . . . . 1.21 110.352 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 90.75 18.76 46.6 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.967 -0.635 . . . . 1.25 112.156 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -84.21 123.17 29.82 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.134 0.492 . . . . 3.18 110.5 -176.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp . . . . . 0 C--O 1.25 1.104 0 CA-C-N 115.404 -0.816 . . . . 6.25 110.433 -179.198 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.688 0 CA-C-O 119.817 -0.435 . . . . 1.54 112.116 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -56.29 115.87 2.78 Favored 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 122.511 2.141 . . . . 1.27 112.65 -176.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.588 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 67.0 mt -107.92 134.51 50.74 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.348 -0.842 . . . . 0.52 110.676 176.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.502 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 11.4 tppt? -80.85 128.31 33.53 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.091 -0.504 . . . . 1.99 112.188 -171.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 41.2 t -90.9 99.29 12.35 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.577 -1.268 . . . . 0.46 107.577 166.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -63.78 -24.82 67.92 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 111.893 0.331 . . . . 3.86 111.893 -173.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -76.46 -30.61 57.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.677 -0.238 . . . . 2.18 111.489 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 67.6 m -97.5 -41.54 8.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.161 0.505 . . . . 0.32 111.141 178.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.55 6.5 50.19 Favored Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 110.827 -0.909 . . . . 0.4 110.827 -178.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.463 ' HE3' ' HE1' ' A' ' 69' ' ' PHE . 25.1 pttt -108.07 -177.57 3.37 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 108.972 -0.751 . . . . 1.28 108.972 -177.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.588 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 50.1 mt-30 -137.31 163.44 30.98 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 116.03 -0.532 . . . . 1.77 110.593 -174.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.542 ' CD1' HD23 ' A' ' 75' ' ' LEU . 14.1 m-85 -132.73 131.33 41.08 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-O 121.121 0.486 . . . . 0.87 110.885 -177.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 1.7 m -67.68 -26.69 66.32 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 114.799 -1.092 . . . . 1.77 112.529 -174.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.4 m -114.28 130.0 56.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.108 0.48 . . . . 0.9 110.255 -178.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.533 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.2 m -56.4 -45.53 80.59 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 114.997 -1.001 . . . . 1.42 111.825 -176.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -63.87 -34.51 90.12 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.634 -0.793 . . . . 0.32 112.086 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 4.1 m-20 -63.05 -44.96 94.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.212 0.054 . . . . 1.81 110.882 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.542 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.4 tm? -72.03 -38.39 69.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.847 0.356 . . . . 0.38 110.176 -178.518 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.594 ' O ' ' HG3' ' A' ' 80' ' ' ARG . 0.1 OUTLIER -62.53 -50.7 70.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.326 -0.397 . . . . 1.93 110.016 178.874 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -59.14 -40.97 87.17 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.627 0.727 . . . . 3.92 110.354 175.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.436 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 77.2 t60 -58.04 -42.82 86.2 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.527 -1.215 . . . . 0.49 111.119 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.473 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 53.7 mt -79.66 -19.17 49.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.174 -0.466 . . . . 0.51 111.836 -177.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.594 ' HG3' ' O ' ' A' ' 76' ' ' LYS . 25.4 mtp180 -62.75 -41.76 99.36 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 108.978 -0.749 . . . . 3.41 108.978 173.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 73.0 mt -65.61 -40.19 87.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.049 -0.978 . . . . 1.83 110.446 176.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.473 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 31.5 m-70 -65.65 -31.89 73.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.896 -0.593 . . . . 0.45 111.858 178.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.5 m -83.93 -58.52 2.75 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.717 0.294 . . . . 1.21 111.069 -178.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.544 ' O ' ' HE2' ' A' ' 86' ' ' LYS . . . 139.7 -40.06 1.45 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.714 -0.755 . . . . 1.25 111.738 -178.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -74.16 98.57 3.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.113 0.482 . . . . 3.18 110.445 176.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.544 ' HE2' ' O ' ' A' ' 84' ' ' GLY . 26.0 mtmt . . . . . 0 C--O 1.249 1.056 0 CA-C-N 115.46 -0.791 . . . . 6.25 109.741 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.458 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . . . . . . 0 N--CA 1.481 1.687 0 CA-C-O 119.617 -0.546 . . . . 1.54 111.989 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.787 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 8.1 Cg_endo -49.61 116.12 2.17 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.052 2.501 . . . . 1.27 112.53 -178.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.668 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 61.1 mt -127.21 107.57 10.13 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.91 -1.041 . . . . 0.52 111.076 179.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.669 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 15.7 ttpt -82.32 134.2 35.26 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.261 0.553 . . . . 1.99 111.033 -175.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 49.4 t -87.27 96.57 10.39 Favored 'General case' 0 N--CA 1.435 -1.208 0 N-CA-C 108.166 -1.05 . . . . 0.46 108.166 173.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 53.4 ttp180 -50.77 -37.71 43.82 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.528 0.517 . . . . 3.86 110.877 179.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.6 mp0 -65.06 -38.77 91.88 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.426 -0.806 . . . . 2.18 112.089 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.475 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 62.7 m -97.16 -41.16 8.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.124 0.488 . . . . 0.32 111.544 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 105.63 0.12 39.78 Favored Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 111.087 -0.805 . . . . 0.4 111.087 -177.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.574 ' O ' ' HG3' ' A' ' 61' ' ' LYS . 14.8 ptmt -95.9 -178.39 4.34 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 115.064 -0.568 . . . . 1.28 109.905 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.669 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 32.4 tt0 -149.04 143.69 26.24 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 116.12 -0.491 . . . . 1.77 110.728 -174.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.787 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 53.9 m-85 -113.61 -173.99 2.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.977 -0.556 . . . . 0.87 109.803 -178.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 13.5 t -134.87 18.86 3.5 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.44 0.638 . . . . 1.77 110.075 175.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 88.6 m -137.89 128.65 26.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.9 110.01 -178.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.668 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 5.3 p -64.14 -59.71 4.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.142 -0.935 . . . . 1.42 112.356 -175.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.18 -34.87 81.8 Favored Glycine 0 C--O 1.229 -0.177 0 C-N-CA 121.003 -0.618 . . . . 0.32 112.819 -177.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -65.08 -48.07 75.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.624 -0.139 . . . . 1.81 110.624 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.552 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.5 tm? -70.09 -37.78 75.5 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.564 -0.289 . . . . 0.38 110.446 -178.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.665 ' O ' ' HG2' ' A' ' 80' ' ' ARG . 7.8 mmpt? -61.19 -49.64 76.36 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.115 -0.328 . . . . 1.93 110.115 177.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -60.34 -40.72 91.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.453 0.644 . . . . 3.92 110.264 175.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.423 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 74.4 t60 -56.04 -44.97 79.31 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.003 -0.998 . . . . 0.49 110.732 177.307 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.564 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 45.9 mt -80.17 -18.65 49.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.245 -0.434 . . . . 0.51 111.637 -178.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.665 ' HG2' ' O ' ' A' ' 76' ' ' LYS . 4.5 mmp_? -60.83 -45.49 94.27 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 108.91 -0.774 . . . . 3.41 108.91 171.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 66.8 mt -60.15 -41.3 86.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.154 -0.93 . . . . 1.83 109.963 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.564 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 39.6 m-70 -65.97 -15.19 62.78 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.879 -0.601 . . . . 0.45 111.632 177.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 33.8 t -101.8 -0.19 34.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.827 0.346 . . . . 1.21 110.764 179.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.1 26.31 64.52 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.898 -0.667 . . . . 1.25 112.673 179.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -73.9 96.1 2.56 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.152 0.501 . . . . 3.18 110.48 178.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 55.0 tttp . . . . . 0 C--O 1.245 0.838 0 CA-C-N 115.272 -0.877 . . . . 6.25 109.717 -179.818 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.427 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . . . . . . 0 N--CA 1.482 1.748 0 CA-C-O 119.414 -0.659 . . . . 1.54 112.166 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.556 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 83.3 Cg_exo -45.48 116.59 1.38 Allowed 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.862 2.375 . . . . 1.27 112.654 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.953 ' HB3' HD12 ' A' ' 75' ' ' LEU . 75.6 mt -132.24 163.83 27.74 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.101 -0.954 . . . . 0.52 109.876 178.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 10.5 tptm -127.12 127.0 43.9 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 120.897 0.379 . . . . 1.99 110.318 -178.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.731 ' SG ' ' CD2' ' A' ' 78' ' ' HIS . 0.5 OUTLIER -100.08 79.62 2.2 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 108.395 -0.965 . . . . 0.46 108.395 -176.214 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -51.1 -36.47 40.56 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 113.176 0.806 . . . . 3.86 113.176 -169.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.721 ' H ' ' CD ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER -65.98 -35.74 81.41 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.984 0.421 . . . . 2.18 110.33 178.614 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.401 ' HB2' ' HB3' ' A' ' 62' ' ' CYS . 72.5 m -92.59 -40.61 10.68 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.9 -0.591 . . . . 0.32 110.659 -176.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.9 11.48 49.77 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.718 -0.953 . . . . 0.4 110.718 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.517 ' HE3' ' CE1' ' A' ' 69' ' ' PHE . 46.0 pttt -108.0 -176.53 3.08 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 114.913 -0.644 . . . . 1.28 109.661 -177.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.448 HE21 ' HB2' ' A' ' 68' ' ' GLN . 1.2 pt20 -138.36 156.45 47.59 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 115.514 -0.766 . . . . 1.77 109.707 -175.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.723 ' CD1' ' HG ' ' A' ' 75' ' ' LEU . 41.8 m-85 -123.4 164.33 19.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.983 0.42 . . . . 0.87 110.683 178.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.2 t -121.21 9.89 10.54 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.47 -0.937 . . . . 1.77 108.47 173.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.471 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 32.0 m -137.74 127.82 25.9 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 114.739 -1.119 . . . . 0.9 109.956 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.413 ' HA ' HD11 ' A' ' 60' ' ' LEU . 19.9 t -71.18 -43.47 67.37 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.81 -0.632 . . . . 1.42 110.816 -177.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.2 -28.8 73.46 Favored Glycine 0 C--N 1.331 0.291 0 C-N-CA 120.907 -0.664 . . . . 0.32 112.678 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.471 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 34.3 m-20 -68.84 -51.57 39.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.456 0.17 . . . . 1.81 110.676 177.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.953 HD12 ' HB3' ' A' ' 60' ' ' LEU . 0.2 OUTLIER -67.46 -37.58 83.17 Favored 'General case' 0 C--O 1.223 -0.323 0 N-CA-C 109.753 -0.462 . . . . 0.38 109.753 179.508 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.569 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -54.73 -52.64 61.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.91 0.386 . . . . 1.93 110.765 177.417 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -63.09 -40.53 97.92 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.321 0.581 . . . . 3.92 110.888 179.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.731 ' CD2' ' SG ' ' A' ' 62' ' ' CYS . 78.0 t60 -69.5 -28.68 66.27 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.527 -0.761 . . . . 0.49 111.063 -178.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.674 ' HG ' HD22 ' A' ' 75' ' ' LEU . 79.7 mt -74.52 -28.24 60.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.92 0.391 . . . . 0.51 110.768 173.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -62.27 -42.26 99.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.018 -0.537 . . . . 3.41 109.928 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.9 tt -76.31 -24.7 16.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 116.27 -0.423 . . . . 1.83 110.725 176.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.559 ' NE2' ' NE2' ' A' ' 78' ' ' HIS . 11.6 m-70 -66.69 -36.51 82.67 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.795 0.331 . . . . 0.45 110.599 174.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.6 m -85.49 -25.81 26.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.043 0.449 . . . . 1.21 111.085 178.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 73.67 29.05 64.07 Favored Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.64 -0.709 . . . . 1.25 112.595 176.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -122.1 173.03 7.82 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.93 0.395 . . . . 3.18 110.71 -176.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? . . . . . 0 C--O 1.249 1.043 0 CA-C-N 115.505 -0.77 . . . . 6.25 110.364 177.854 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.598 0 N-CA-C 111.894 -0.482 . . . . 1.54 111.894 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.577 ' HB3' ' NE2' ' A' ' 68' ' ' GLN . 48.2 Cg_exo -57.63 115.02 2.22 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.507 2.138 . . . . 1.27 112.878 -173.052 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.534 HD12 ' HA ' ' A' ' 72' ' ' SER . 80.4 mt -109.31 116.35 31.7 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 114.943 -1.026 . . . . 0.52 110.195 176.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 2.4 mppt? -82.28 133.93 35.26 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.568 0.699 . . . . 1.99 111.663 -174.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.436 ' SG ' ' HB2' ' A' ' 64' ' ' GLU . 44.8 t -78.05 97.26 5.33 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 114.782 -1.099 . . . . 0.46 108.087 170.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -56.22 -22.74 31.26 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.201 0.524 . . . . 3.86 111.132 -177.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.436 ' HB2' ' SG ' ' A' ' 62' ' ' CYS . 16.3 mm-40 -72.44 -37.37 68.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.917 -0.583 . . . . 2.18 111.339 177.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.459 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 89.4 m -107.77 -41.45 5.0 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.594 0.59 . . . . 0.32 112.594 -173.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 108.89 -6.46 32.88 Favored Glycine 0 N--CA 1.452 -0.246 0 N-CA-C 111.416 -0.674 . . . . 0.4 111.416 -176.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.497 ' O ' ' HA ' ' A' ' 61' ' ' LYS . 0.0 OUTLIER -85.67 -178.17 6.57 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 122.982 0.513 . . . . 1.28 109.655 178.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.577 ' NE2' ' HB3' ' A' ' 59' ' ' PRO . 20.0 pt20 -145.35 153.84 41.67 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 116.015 -0.539 . . . . 1.77 111.37 -172.254 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.512 ' CD1' HD23 ' A' ' 75' ' ' LEU . 56.9 m-85 -135.8 121.93 20.22 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.288 -0.415 . . . . 0.87 109.93 176.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.7 t -71.92 -10.81 60.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.113 0.483 . . . . 1.77 111.083 -177.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 18.7 m -110.76 129.85 55.73 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.985 -0.552 . . . . 0.9 110.218 178.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.534 ' HA ' HD12 ' A' ' 60' ' ' LEU . 49.2 m -65.81 -41.9 91.31 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.441 -0.8 . . . . 1.42 112.306 -173.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.04 -36.02 92.73 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.057 -0.592 . . . . 0.32 112.583 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -62.99 -50.24 71.51 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.401 -0.222 . . . . 1.81 110.401 178.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.512 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.1 tm? -68.19 -33.47 74.49 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.389 -0.369 . . . . 0.38 110.304 -178.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.557 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -65.46 -51.25 61.49 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.654 0.264 . . . . 1.93 110.459 178.045 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.479 ' O ' ' HD3' ' A' ' 77' ' ' ARG . 3.6 tmt_? -64.26 -34.49 78.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.313 0.578 . . . . 3.92 109.445 176.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 62.1 t60 -60.37 -51.92 67.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.452 -0.794 . . . . 0.49 110.94 177.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.476 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 31.3 mt -75.28 -19.66 59.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.384 -0.371 . . . . 0.51 111.315 -179.066 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.513 ' HG3' ' HG3' ' A' ' 85' ' ' GLU . 42.7 ttm180 -55.99 -54.89 39.35 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.445 -0.576 . . . . 3.41 109.445 171.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 45.9 mm -57.74 -40.29 74.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.68 -0.691 . . . . 1.83 109.956 178.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.476 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 45.4 m-70 -64.01 -28.01 69.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.562 -0.744 . . . . 0.45 112.091 178.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.1 m -87.18 2.0 51.33 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.674 0.273 . . . . 1.21 111.455 -176.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 89.16 14.34 60.63 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.419 -0.896 . . . . 1.25 112.696 177.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.513 ' HG3' ' HG3' ' A' ' 80' ' ' ARG . 7.1 pt-20 -116.95 140.6 49.27 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.16 -0.681 . . . . 3.18 109.16 176.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm . . . . . 0 C--N 1.314 -0.949 0 CA-C-O 118.725 -0.655 . . . . 6.25 111.414 -171.717 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.699 0 N-CA-C 111.895 -0.482 . . . . 1.54 111.895 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.46 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 89.5 Cg_exo -44.4 116.94 1.2 Allowed 'Trans proline' 0 C--O 1.235 0.367 0 C-N-CA 123.497 2.798 . . . . 1.27 113.59 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.564 HD12 ' HA ' ' A' ' 72' ' ' SER . 91.6 mt -126.11 124.64 41.02 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.127 -0.942 . . . . 0.52 110.782 175.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.1 tppt? -82.91 140.18 32.98 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.819 -0.628 . . . . 1.99 111.526 -174.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 45.7 t -96.86 95.38 7.82 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 107.746 -1.205 . . . . 0.46 107.746 164.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 42.3 ttp180 -52.17 -36.3 51.33 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 123.398 0.436 . . . . 3.86 111.748 -177.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -71.62 -35.13 70.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.1 -0.5 . . . . 2.18 111.355 -175.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.441 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 65.3 m -94.02 -41.48 9.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.168 0.509 . . . . 0.32 111.364 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 103.71 6.03 44.17 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 111.205 -0.758 . . . . 0.4 111.205 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.558 ' HE2' ' CZ ' ' A' ' 69' ' ' PHE . 11.5 ptmt -101.41 -177.31 3.4 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.101 -0.549 . . . . 1.28 109.912 -178.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.43 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 35.6 tt0 -150.86 142.23 23.37 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.748 -0.66 . . . . 1.77 110.078 -168.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.638 ' CD1' HD23 ' A' ' 75' ' ' LEU . 88.1 m-85 -123.6 150.64 43.87 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-O 120.824 0.345 . . . . 0.87 111.09 -174.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.4 p -90.91 -25.26 19.9 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.164 -0.471 . . . . 1.77 111.69 -177.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.486 HG23 ' CB ' ' A' ' 74' ' ' ASN . 0.5 OUTLIER -108.72 132.7 53.69 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.588 0.709 . . . . 0.9 110.648 -179.825 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.564 ' HA ' HD12 ' A' ' 60' ' ' LEU . 66.2 m -64.57 -43.8 92.73 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 114.763 -1.108 . . . . 1.42 111.787 -174.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -62.62 -33.47 86.74 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.574 -0.822 . . . . 0.32 112.326 -177.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.503 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 62.0 t30 -69.29 -40.56 77.64 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.096 -0.242 . . . . 1.81 110.371 -179.227 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.638 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.6 tm? -76.47 -34.68 58.68 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.586 0.231 . . . . 0.38 110.552 -179.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.571 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 8.8 mmpt? -64.85 -46.58 81.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.652 0.263 . . . . 1.93 110.35 177.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -60.95 -41.72 96.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.694 0.759 . . . . 3.92 109.736 174.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.503 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 61.3 t60 -58.51 -46.88 85.81 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.292 -1.322 . . . . 0.49 111.23 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.563 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 28.8 mt -83.81 -18.86 36.24 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 111.919 0.34 . . . . 0.51 111.919 -176.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -61.86 -48.18 81.67 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.803 -0.443 . . . . 3.41 109.803 174.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 13.9 tt -70.14 -29.46 39.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.3 -0.409 . . . . 1.83 110.481 178.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.563 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 18.3 m-70 -63.65 -29.54 70.76 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.008 0.432 . . . . 0.45 110.29 173.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 47.5 m -85.81 3.2 42.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.986 -0.552 . . . . 1.21 111.126 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 91.75 -6.11 79.71 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.758 -0.734 . . . . 1.25 112.662 177.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -83.42 110.55 18.25 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.738 0.304 . . . . 3.18 110.413 -178.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt . . . . . 0 C--O 1.245 0.859 0 CA-C-O 118.64 -0.695 . . . . 6.25 110.124 179.219 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.721 0 CA-C-O 119.582 -0.565 . . . . 1.54 111.772 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.578 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 27.5 Cg_endo -62.55 115.85 3.16 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 121.651 1.567 . . . . 1.27 111.028 178.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.695 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 67.9 mt -97.57 129.76 44.67 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.268 -0.878 . . . . 0.52 111.809 -175.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 40.8 tptt -81.4 126.14 31.26 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.214 -0.903 . . . . 1.99 111.151 -172.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 28.8 t -80.39 117.29 21.01 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.721 -0.844 . . . . 0.46 108.721 171.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -60.23 -34.97 74.42 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.661 0.615 . . . . 3.86 112.661 -172.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -94.1 -21.59 19.02 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.64 -0.424 . . . . 2.18 111.943 -172.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.417 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 84.3 m -99.35 -41.07 7.59 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.648 -0.421 . . . . 0.32 111.961 -179.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 97.58 2.52 58.69 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.707 -0.758 . . . . 0.4 111.517 -177.447 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.677 ' HE3' ' CE1' ' A' ' 69' ' ' PHE . 0.0 OUTLIER -90.7 -176.72 4.8 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 109.764 -0.458 . . . . 1.28 109.764 178.429 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.695 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 4.6 pt20 -150.0 148.35 28.95 Favored 'General case' 0 C--N 1.309 -1.196 0 CA-C-N 115.898 -0.592 . . . . 1.77 111.114 -173.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.677 ' CE1' ' HE3' ' A' ' 67' ' ' LYS . 32.1 m-85 -122.44 133.29 54.62 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.315 -0.402 . . . . 0.87 111.51 -176.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.4 t -74.14 -16.28 61.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.329 0.585 . . . . 1.77 110.32 177.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.53 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 13.1 m -109.91 128.95 55.68 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.047 -0.524 . . . . 0.9 110.136 177.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.558 ' HA ' HD12 ' A' ' 60' ' ' LEU . 42.5 t -69.16 -40.76 77.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.513 -0.767 . . . . 1.42 110.901 -176.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.36 -38.49 95.03 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.656 -0.783 . . . . 0.32 111.983 178.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.53 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 39.9 m-20 -61.05 -43.08 99.43 Favored 'General case' 0 C--O 1.221 -0.435 0 C-N-CA 121.434 -0.106 . . . . 1.81 110.927 178.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.523 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.6 tm? -69.79 -37.37 76.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.816 0.341 . . . . 0.38 110.267 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.544 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -66.96 -45.5 77.57 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.841 -0.344 . . . . 1.93 110.11 179.734 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.57 ' O ' ' HB3' ' A' ' 80' ' ' ARG . 4.9 tmt_? -64.99 -33.91 77.18 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.441 0.639 . . . . 3.92 109.817 175.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.433 ' O ' HG22 ' A' ' 81' ' ' ILE . 73.6 t60 -63.92 -43.77 94.92 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.307 -0.861 . . . . 0.49 110.616 177.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.602 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 44.1 mt -80.05 -18.59 49.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.942 0.401 . . . . 0.51 110.635 178.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.57 ' HB3' ' O ' ' A' ' 77' ' ' ARG . 28.7 tpt180 -56.31 -47.61 78.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.021 -0.536 . . . . 3.41 109.936 172.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.433 HG22 ' O ' ' A' ' 78' ' ' HIS . 9.0 tp -74.7 -27.35 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 120.647 -0.421 . . . . 1.83 110.606 178.452 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.602 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 28.5 m-70 -65.63 -26.03 67.64 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.087 0.47 . . . . 0.45 110.955 174.153 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 56.7 m -74.78 -22.08 58.96 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.981 -0.554 . . . . 1.21 110.523 176.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.91 -3.04 72.03 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 121.021 -0.609 . . . . 1.25 112.802 177.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -68.15 119.38 12.64 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 121.096 0.474 . . . . 3.18 110.87 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.246 0.915 0 CA-C-N 115.349 -0.841 . . . . 6.25 109.751 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.886 0 CA-C-O 119.785 -0.453 . . . . 1.54 112.098 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.48 ' CB ' ' HB3' ' A' ' 68' ' ' GLN . 70.6 Cg_exo -52.61 115.99 2.58 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.451 2.101 . . . . 1.27 112.244 -179.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.681 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 99.5 mt -86.1 128.96 34.97 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.058 -0.974 . . . . 0.52 110.62 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 67' ' ' LYS . 5.5 tppp? -81.8 129.75 34.84 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.246 -0.434 . . . . 1.99 111.627 -172.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 19.5 t -82.5 128.77 34.6 Favored 'General case' 0 N--CA 1.442 -0.854 0 N-CA-C 108.688 -0.856 . . . . 0.46 108.688 169.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.511 ' HA ' ' NE ' ' A' ' 63' ' ' ARG . 1.2 mmp_? -71.14 -38.88 72.23 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.109 -0.496 . . . . 3.86 111.973 -172.217 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -90.46 -12.27 37.86 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.164 0.431 . . . . 2.18 112.164 -174.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.482 ' HB2' ' HG2' ' A' ' 67' ' ' LYS . 99.1 m -109.67 -41.72 4.48 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.652 -0.419 . . . . 0.32 111.703 178.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 96.19 1.3 61.12 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.513 -0.851 . . . . 0.4 111.698 -177.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.501 ' HE2' ' CE1' ' A' ' 69' ' ' PHE . 17.9 ptmt -88.28 -177.72 5.74 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 122.816 0.446 . . . . 1.28 110.126 179.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.681 ' HA ' ' O ' ' A' ' 60' ' ' LEU . 57.3 mt-30 -145.14 144.11 30.72 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.733 -0.667 . . . . 1.77 111.405 -170.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.552 ' CD1' HD23 ' A' ' 75' ' ' LEU . 50.4 m-85 -123.1 135.92 54.58 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.162 -0.472 . . . . 0.87 111.454 -178.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.6 p -83.67 -4.52 58.67 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.256 -0.429 . . . . 1.77 111.448 -178.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.488 ' HB ' ' HB2' ' A' ' 74' ' ' ASN . 28.5 m -123.76 129.64 51.38 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.981 -0.554 . . . . 0.9 109.924 -179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 39.1 t -61.11 -52.89 62.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.416 -0.811 . . . . 1.42 111.579 -175.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -61.95 -29.22 71.89 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.883 -0.675 . . . . 0.32 112.424 179.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.488 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 0.9 OUTLIER -66.39 -37.74 85.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.565 0.221 . . . . 1.81 110.672 178.72 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.552 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.8 tm? -81.06 -32.01 34.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.373 -0.376 . . . . 0.38 110.299 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.564 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.1 OUTLIER -67.39 -47.0 71.61 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.754 0.279 . . . . 1.93 111.754 179.148 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.61 -31.74 73.09 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.9 0.857 . . . . 3.92 109.092 176.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.422 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 72.7 t60 -65.29 -52.09 56.49 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.229 -1.35 . . . . 0.49 110.45 179.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.512 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 19.3 mt -76.28 -18.65 58.88 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.083 -0.508 . . . . 0.51 111.295 -179.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.432 ' HG3' ' HB2' ' A' ' 85' ' ' GLU . 24.5 ttt180 -55.44 -47.06 76.61 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.194 -0.669 . . . . 3.41 109.194 170.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 47.7 mm -61.8 -41.57 91.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.415 -0.812 . . . . 1.83 110.314 175.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.512 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 62.7 m-70 -70.12 -23.81 63.08 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.8 -0.637 . . . . 0.45 112.542 -177.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 22.2 m -85.52 -11.51 53.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.908 0.385 . . . . 1.21 111.062 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 87.9 22.85 40.67 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.693 -0.765 . . . . 1.25 111.9 -178.049 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.432 ' HB2' ' HG3' ' A' ' 80' ' ' ARG . 8.7 mm-40 -90.78 125.61 35.76 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.285 -0.635 . . . . 3.18 109.285 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 51.8 tttp . . . . . 0 C--O 1.248 1.015 0 CA-C-N 115.744 -0.662 . . . . 6.25 110.621 -176.299 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.754 0 N-CA-C 112.245 -0.342 . . . . 1.54 112.245 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.951 ' HB2' HE21 ' A' ' 68' ' ' GLN . 17.4 Cg_exo -69.01 117.59 5.13 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 122.13 1.887 . . . . 1.27 111.13 174.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.694 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 83.6 mt -83.55 131.67 34.97 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.027 -0.988 . . . . 0.52 111.001 -176.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.567 ' HA ' ' HG2' ' A' ' 68' ' ' GLN . 48.5 tptt -81.82 122.24 27.46 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.839 -0.619 . . . . 1.99 111.888 -171.062 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 42.3 t -91.73 96.9 10.68 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 107.406 -1.331 . . . . 0.46 107.406 169.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 63' ' ' ARG . 59.7 mtt85 -57.49 -30.94 65.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.07 0.462 . . . . 3.86 110.973 -177.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -69.18 -37.29 78.07 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.7 -0.682 . . . . 2.18 110.987 -176.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . 0.418 ' HB3' ' HD3' ' A' ' 67' ' ' LYS . 67.7 m -94.57 -42.13 8.97 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 121.639 0.733 . . . . 0.32 111.2 177.252 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.63 3.01 43.54 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-N 114.891 -1.05 . . . . 0.4 111.32 -177.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.418 ' HD3' ' HB3' ' A' ' 65' ' ' CYS . 18.1 pttt -108.36 -178.24 3.55 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-O 120.886 0.374 . . . . 1.28 110.07 -176.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.951 HE21 ' HB2' ' A' ' 59' ' ' PRO . 29.0 mt-30 -141.35 147.28 37.83 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.718 -0.674 . . . . 1.77 111.356 -168.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.468 ' CD1' HD23 ' A' ' 75' ' ' LEU . 54.1 m-85 -126.81 125.0 40.97 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.403 -0.362 . . . . 0.87 111.256 -176.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.7 p -68.42 -22.21 64.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.369 -0.378 . . . . 1.77 111.877 -176.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.01 129.28 48.26 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.227 0.537 . . . . 0.9 110.644 179.223 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.557 ' O ' ' HG2' ' A' ' 76' ' ' LYS . 40.7 t -65.59 -43.77 88.68 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.283 -0.871 . . . . 1.42 111.039 -176.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.44 ' O ' ' HG3' ' A' ' 77' ' ' ARG . . . -68.72 -33.35 75.69 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.901 -0.666 . . . . 0.32 111.983 179.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -57.68 -45.14 86.0 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.347 -0.612 . . . . 1.81 109.347 176.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.468 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.2 tm? -71.04 -31.25 67.66 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.702 -0.681 . . . . 0.38 110.379 179.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.557 ' HG2' ' O ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -65.04 -50.75 65.01 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.886 0.374 . . . . 1.93 109.999 176.851 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 73' ' ' GLY . 81.3 mtt180 -59.28 -39.19 82.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.673 0.749 . . . . 3.92 109.573 174.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -63.18 -36.92 85.22 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.625 -1.17 . . . . 0.49 111.45 -177.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.531 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 37.1 mt -85.74 -23.85 27.16 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 122.212 -0.305 . . . . 0.51 111.242 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.444 ' HA ' ' O ' ' A' ' 85' ' ' GLU . 46.3 ttp180 -59.11 -38.64 80.04 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.924 -0.398 . . . . 3.41 109.924 173.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 17.2 tt -82.22 -26.15 9.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 C-N-CA 120.83 -0.348 . . . . 1.83 110.564 178.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.531 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 13.3 m-70 -66.29 -47.19 74.42 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.801 0.334 . . . . 0.45 110.842 175.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.4 m -86.73 -13.16 46.13 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.295 -0.411 . . . . 1.21 110.962 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 88.15 -9.5 74.65 Favored Glycine 0 N--CA 1.453 -0.195 0 C-N-CA 121.007 -0.616 . . . . 1.25 111.738 -178.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.444 ' O ' ' HA ' ' A' ' 80' ' ' ARG . 0.2 OUTLIER -150.76 167.35 27.69 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 122.659 0.384 . . . . 3.18 110.421 -179.857 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 84.0 tttt . . . . . 0 C--O 1.243 0.736 0 CA-C-O 118.481 -0.771 . . . . 6.25 109.284 172.871 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.8 0 CA-C-O 119.644 -0.531 . . . . 1.54 112.065 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.838 ' HA ' ' O ' ' A' ' 69' ' ' PHE . 81.7 Cg_exo -47.62 115.91 1.62 Allowed 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 122.45 2.1 . . . . 1.27 112.152 176.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.473 ' CD1' ' HA ' ' A' ' 72' ' ' SER . 62.1 mt -130.71 123.94 30.41 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 115.812 -0.631 . . . . 0.52 111.397 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.9 tptm -82.04 129.59 34.84 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.3 -0.864 . . . . 1.99 110.572 -174.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 47.3 t -86.39 97.07 10.24 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 108.119 -1.067 . . . . 0.46 108.119 172.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 38.5 mtp180 -59.47 -23.77 63.01 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.721 0.296 . . . . 3.86 111.56 -175.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -84.56 -20.97 30.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.531 -0.304 . . . . 2.18 111.425 -178.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 55.4 m -107.2 -41.97 4.98 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.923 0.392 . . . . 0.32 111.769 178.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 104.72 -3.11 42.04 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.742 -0.742 . . . . 0.4 111.722 -179.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.42 -176.85 3.19 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 109.54 -0.541 . . . . 1.28 109.54 178.454 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -139.81 149.89 44.05 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 116.126 -0.488 . . . . 1.77 110.492 -162.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.838 ' O ' ' HA ' ' A' ' 59' ' ' PRO . 55.7 m-85 -117.27 179.76 3.95 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 116.345 -0.389 . . . . 0.87 110.476 -179.299 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 25.4 p -129.54 17.83 5.84 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.129 0.49 . . . . 1.77 111.051 -179.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.631 ' HB ' ' CB ' ' A' ' 74' ' ' ASN . 22.7 m -141.97 129.46 21.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.92 -0.582 . . . . 0.9 109.767 -179.019 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.473 ' HA ' ' CD1' ' A' ' 60' ' ' LEU . 11.9 m -66.2 -42.08 89.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.644 -0.707 . . . . 1.42 111.296 -175.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.61 -35.42 59.21 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.449 -0.882 . . . . 0.32 111.953 177.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.631 ' CB ' ' HB ' ' A' ' 71' ' ' THR . 43.6 t-20 -58.59 -50.68 72.94 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.706 0.289 . . . . 1.81 110.319 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.489 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.2 tm? -75.41 -32.49 60.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.112 -0.495 . . . . 0.38 111.184 -175.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.61 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -69.7 -45.11 68.99 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.84 -0.744 . . . . 1.93 110.186 -178.575 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 9.7 tpp180 -62.7 -33.51 75.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.758 0.79 . . . . 3.92 109.414 174.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.435 ' HB3' ' O ' ' A' ' 75' ' ' LEU . 65.8 t60 -65.0 -39.0 92.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.421 -1.263 . . . . 0.49 110.706 177.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.505 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 54.3 mt -81.83 -23.63 36.32 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.534 -0.303 . . . . 0.51 111.808 -179.446 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.814 ' HA ' ' O ' ' A' ' 85' ' ' GLU . 71.6 ttt180 -62.28 -40.09 95.1 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.678 -0.489 . . . . 3.41 109.678 173.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.5 tt -83.25 -10.82 11.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-O 121.07 0.462 . . . . 1.83 110.86 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.505 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 13.6 m-70 -86.35 -47.3 9.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.263 -0.426 . . . . 0.45 110.501 173.607 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.0 m -85.68 -25.75 26.35 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.034 -0.53 . . . . 1.21 111.056 -174.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 95.02 -0.82 64.59 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 110.999 -0.841 . . . . 1.25 110.999 -175.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.814 ' O ' ' HA ' ' A' ' 80' ' ' ARG . 4.5 pt-20 -150.42 -179.85 7.56 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.416 -0.392 . . . . 3.18 111.341 -177.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt . . . . . 0 C--O 1.246 0.908 0 O-C-N 124.361 1.038 . . . . 6.25 112.292 -177.461 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.666 0 CA-C-O 119.651 -0.527 . . . . 1.54 112.107 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -55.78 116.45 3.17 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.664 2.242 . . . . 1.27 112.491 -178.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' A' ' 68' ' ' GLN . 88.7 mt -121.0 103.64 9.2 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.361 -1.29 . . . . 0.52 110.309 177.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.929 ' HA ' ' HA ' ' A' ' 68' ' ' GLN . 24.4 mtmm -78.99 130.19 35.27 Favored 'General case' 0 CA--C 1.511 -0.529 0 C-N-CA 120.389 -0.524 . . . . 1.99 110.806 -175.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 35.7 t -68.35 110.29 4.03 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 108.593 -0.891 . . . . 0.46 108.593 170.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.6 ttp180 -57.93 -30.43 65.94 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 123.171 0.294 . . . . 3.86 111.741 -175.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -85.29 -26.78 26.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.57 -0.286 . . . . 2.18 111.663 -174.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 93.6 m -103.15 -40.24 6.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.968 0.413 . . . . 0.32 111.278 -178.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 101.75 -1.11 52.32 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 121.141 -0.552 . . . . 0.4 112.043 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.4 ' HE3' ' CE1' ' A' ' 78' ' ' HIS . 0.0 OUTLIER -108.95 129.86 55.44 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 122.129 0.966 . . . . 1.28 110.739 -179.802 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.929 ' HA ' ' HA ' ' A' ' 61' ' ' LYS . 3.8 pt20 -81.33 161.9 23.65 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 113.384 -1.735 . . . . 1.77 112.917 -176.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.586 ' CD1' HD23 ' A' ' 75' ' ' LEU . 34.1 m-85 -130.92 131.8 44.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.702 -1.136 . . . . 0.87 109.446 176.128 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.7 t -84.05 -4.53 58.82 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.005 0.431 . . . . 1.77 111.147 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.2 m -115.52 129.27 56.48 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.264 0.554 . . . . 0.9 110.201 179.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.8 p -65.65 -50.06 66.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.177 -0.919 . . . . 1.42 111.854 -175.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -59.65 -29.52 67.17 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.839 -0.696 . . . . 0.32 112.575 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.462 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 6.0 m120 -68.59 -55.02 12.98 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.327 0.108 . . . . 1.81 110.766 176.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.586 HD23 ' CD1' ' A' ' 69' ' ' PHE . 1.1 tm? -69.82 -32.23 70.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.624 -0.262 . . . . 0.38 111.123 -175.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 20.8 mmmt -67.68 -51.62 47.49 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.733 -0.387 . . . . 1.93 111.328 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -64.68 -29.13 70.12 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.592 0.71 . . . . 3.92 109.565 176.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.462 ' HB2' ' O ' ' A' ' 74' ' ' ASN . 53.3 t60 -64.44 -48.86 73.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.972 -1.013 . . . . 0.49 110.587 177.005 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.497 ' HA ' ' HB2' ' A' ' 82' ' ' HIS . 33.1 mt -79.49 -19.55 49.44 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.723 0.296 . . . . 0.51 111.04 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.534 ' HG3' ' HB3' ' A' ' 85' ' ' GLU . 60.8 ttt180 -58.54 -48.68 80.06 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.062 -0.517 . . . . 3.41 110.385 175.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.0 tt -72.3 -30.14 34.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.459 -0.337 . . . . 1.83 110.326 178.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.497 ' HB2' ' HA ' ' A' ' 79' ' ' LEU . 33.4 m-70 -64.21 -41.24 97.13 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.104 0.478 . . . . 0.45 110.791 174.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 10.8 t -74.38 -12.05 60.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.965 -0.561 . . . . 1.21 110.589 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 86.46 23.23 44.3 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 121.021 -0.609 . . . . 1.25 112.661 177.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.534 ' HB3' ' HG3' ' A' ' 80' ' ' ARG . 7.1 tp10 -80.52 90.06 5.67 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 121.333 0.587 . . . . 3.18 109.942 179.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 57.9 tptt . . . . . 0 C--O 1.248 1.021 0 CA-C-N 115.35 -0.841 . . . . 6.25 109.963 -179.614 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_