data_2mbv_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 2mbv _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 ' 79' ' ' ARG . . . . . 0.743 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 9.3 ptt-85 . . . . . 0 N--CA 1.457 -0.122 0 CA-C-O 121.408 0.623 . . . . 0.0 109.691 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.974 HD12 ' HA ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -94.5 46.73 1.15 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.535 -171.527 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 51.0 35.35 12.52 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 121.498 0.666 . . . . 0.0 110.874 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 121.38 -129.2 7.64 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 -173.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.974 ' HA ' HD12 ' A' ' 80' ' ' LEU . 64.6 t30 -142.74 79.84 1.67 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.128 0.49 . . . . 0.0 111.462 175.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.29 -55.48 2.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.947 174.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 177.79 144.35 5.42 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.822 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.952 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -160.51 158.79 29.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.642 0.221 . . . . 0.0 110.836 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.804 ' HB2' ' HA ' ' A' ' 108' ' ' TYR . 0.1 OUTLIER -86.83 145.76 26.48 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.982 178.474 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.2 -12.54 60.91 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.088 -0.383 . . . . 0.0 111.714 -178.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -82.86 -47.87 11.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.586 0.231 . . . . 0.0 110.718 -177.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 2.6 p -126.84 -42.87 1.73 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.753 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.743 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 75.19 15.74 80.97 Favored Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.842 -0.617 . . . . 0.0 113.682 179.158 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.3 76.0 8.25 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 117.184 0.492 . . . . 0.0 111.687 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.665 ' HA ' HG22 ' A' ' 414' ' ' THR . 0.7 OUTLIER 62.43 128.67 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 O-C-N 124.228 0.955 . . . . 0.0 113.458 172.765 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.583 HG21 HG11 ' A' ' 100' ' ' VAL . 1.3 mt -103.82 99.51 16.46 Favored Pre-proline 0 C--N 1.32 -0.69 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 170.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.45 ' HD3' ' O ' ' A' ' 93' ' ' SER . 5.4 Cg_exo -78.54 159.17 28.84 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.175 2.583 . . . . 0.0 112.103 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.95 -16.89 56.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.372 0.606 . . . . 0.0 109.674 174.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.1 -35.25 31.9 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.965 -178.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.4 ' CD ' ' HZ1' ' A' ' 111' ' ' LYS . 4.6 mt-10 -100.74 118.45 36.86 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.9 mt -68.78 139.4 55.28 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.66 -179.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.583 HG11 HG21 ' A' ' 94' ' ' ILE . 2.7 m -117.74 148.75 20.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.284 0.564 . . . . 0.0 111.38 -176.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.437 ' HE1' ' CD2' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -89.7 115.85 27.38 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.994 -177.302 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 18.6 ptt180 -112.04 135.46 52.65 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.333 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -113.67 -122.59 0.29 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.201 -177.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.23 -54.13 48.04 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.071 0.462 . . . . 0.0 111.506 -176.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -162.1 31.83 0.32 Allowed Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -140.56 158.77 43.5 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -177.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -120.53 139.76 46.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.691 -176.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . 0.804 ' HA ' ' HB2' ' A' ' 87' ' ' CYS . 74.5 m-85 -137.46 160.34 39.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.36 178.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.778 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 29.0 m80 -85.84 152.2 23.19 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.5 pp -65.86 -21.17 66.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.0 0.428 . . . . 0.0 111.045 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.525 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.86 -23.47 21.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.196 0.522 . . . . 0.0 110.335 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.778 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 12.4 m -94.2 -2.3 52.73 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.331 -178.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . 0.588 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.0 OUTLIER -76.62 74.75 3.31 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.229 0.538 . . . . 0.0 110.33 177.127 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.579 HG23 ' HA ' ' A' ' 121' ' ' ARG . 2.2 p -130.6 154.26 48.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.06 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.54 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 17.0 p -72.56 150.91 42.73 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.099 0.476 . . . . 0.0 110.273 177.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.05 2.0 52.92 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.478 -177.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.62 -50.78 3.34 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -176.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.64 -2.78 10.92 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.841 0.353 . . . . 0.0 110.93 -177.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 62.24 41.15 10.78 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.782 -179.383 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . 0.575 HD21 ' HB2' ' A' ' 137' ' ' CYS . 10.7 t30 -89.44 128.78 35.99 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.579 ' HA ' HG23 ' A' ' 114' ' ' THR . 0.0 OUTLIER -72.45 126.76 30.63 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.826 0.345 . . . . 0.0 110.316 -177.894 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.469 HD23 ' HB2' ' A' ' 128' ' ' PHE . 0.7 OUTLIER -80.86 132.88 35.5 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.564 179.625 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.535 HG12 ' HD2' ' A' ' 124' ' ' PRO . 0.5 OUTLIER -127.24 139.28 34.7 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.789 -173.094 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . 0.535 ' HD2' HG12 ' A' ' 123' ' ' VAL . 32.4 Cg_exo -58.98 110.93 0.75 Allowed 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.213 1.942 . . . . 0.0 110.612 171.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 112.65 -5.83 26.16 Favored Glycine 0 N--CA 1.447 -0.586 0 N-CA-C 111.26 -0.736 . . . . 0.0 111.26 -174.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -117.52 165.7 13.24 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 176.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 2.0 mtm-85 -93.81 131.32 39.29 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.122 0.487 . . . . 0.0 111.348 -174.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.469 ' HB2' HD23 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -138.63 171.84 13.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.22 -179.386 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . 0.611 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 86.1 m-70 -131.94 133.77 44.9 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.786 0.327 . . . . 0.0 110.776 178.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.479 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 69.2 t80 -125.47 101.61 7.01 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 1.5 mt -129.83 128.92 65.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.432 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 63.93 18.28 11.09 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 123.515 0.509 . . . . 0.0 110.992 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.479 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 81.82 30.52 35.28 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.225 -176.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.47 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.9 OUTLIER -126.13 155.33 41.84 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 -176.894 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.2 mt -108.21 123.7 49.16 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.161 0.505 . . . . 0.0 111.286 -174.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.611 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 22.1 m-85 -129.71 174.9 9.27 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 174.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . 0.575 ' HB2' HD21 ' A' ' 120' ' ' ASN . 10.4 p -127.62 -175.82 3.58 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.457 0.646 . . . . 0.0 111.589 -174.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.476 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -72.77 -25.52 61.2 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.279 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 47.4 t60 -76.9 -39.2 51.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.769 -175.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.466 ' OD1' ' HB3' ' A' ' 136' ' ' PHE . 1.7 p30 -85.28 -58.77 2.55 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.364 178.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 55.27 72.29 1.09 Allowed Pre-proline 0 C--N 1.327 -0.397 0 C-N-CA 123.146 0.579 . . . . 0.0 111.971 174.019 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.0 99.51 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.39 2.06 . . . . 0.0 111.866 176.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' THR . . . . . 0.738 ' HA ' HG23 ' A' ' 146' ' ' ILE . 0.1 OUTLIER -92.56 -21.25 20.2 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.53 -171.943 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -68.32 -24.41 64.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.601 -178.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -141.25 60.23 1.51 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.062 0.458 . . . . 0.0 111.253 -178.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.738 HG23 ' HA ' ' A' ' 143' ' ' THR . 1.0 OUTLIER . . . . . 0 C--N 1.322 -0.6 0 CA-C-O 121.592 0.711 . . . . 0.0 110.102 176.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.453 0 N-CA-C 112.684 -0.166 . . . . 0.0 112.684 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.23 130.33 36.37 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.855 0.359 . . . . 0.0 110.755 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . 0.455 HD13 HG23 ' A' ' 404' ' ' ILE . 35.7 mm -120.15 137.47 53.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.912 -176.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . 0.486 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -61.82 133.57 93.77 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.479 -177.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . 0.588 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 15.2 Cg_exo -68.69 172.48 11.51 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.111 2.541 . . . . 0.0 112.401 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -97.1 158.1 33.87 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.144 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -88.91 128.63 1.97 Allowed 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.762 2.308 . . . . 0.0 112.976 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . 0.51 ' O ' HG22 ' A' ' 100' ' ' VAL . 1.2 mt-10 -130.73 163.03 28.16 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -77.29 127.98 33.54 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 122.088 -0.383 . . . . 0.0 110.371 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -105.75 -84.29 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.56 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.4 OUTLIER -131.53 144.27 52.69 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.046 -176.118 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 5.6 Cg_exo -79.38 147.04 19.98 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.886 2.391 . . . . 0.0 111.037 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 414' ' ' THR . . . . . 0.665 HG22 ' HA ' ' A' ' 93' ' ' SER . 0.2 OUTLIER -86.55 147.62 25.87 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.831 0.348 . . . . 0.0 111.2 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 12.5 m . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.68 177.898 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.497 ' HE ' ' HA2' ' A' ' 91' ' ' GLY . 19.9 ptt180 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.983 0.42 . . . . 0.0 110.613 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.448 ' HB3' ' HB3' ' A' ' 86' ' ' ALA . 0.9 OUTLIER -113.08 -174.72 2.51 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.89 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -77.73 -35.97 51.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.96 0.409 . . . . 0.0 110.921 -177.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -116.34 -129.53 4.41 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 177.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 18.6 p30 -147.01 22.56 1.22 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.211 0.529 . . . . 0.0 110.356 175.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.87 -58.78 3.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.115 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -170.16 146.78 10.16 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 111.519 -0.633 . . . . 0.0 111.519 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.448 ' HB3' ' HB3' ' A' ' 80' ' ' LEU . . . -129.06 141.83 51.09 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.771 0.319 . . . . 0.0 110.986 -177.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.699 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 41.9 t -62.38 145.84 52.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.137 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.41 -25.42 42.09 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.611 176.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -96.0 -47.95 5.89 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.139 -177.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 56.0 m -83.06 -62.66 1.54 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.254 0.55 . . . . 0.0 110.244 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.699 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 118.19 -19.39 10.92 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.426 -175.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -78.11 177.38 8.38 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.937 0.399 . . . . 0.0 110.922 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -84.76 173.82 10.38 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.699 -174.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.659 HG23 HG22 ' A' ' 100' ' ' VAL . 2.3 mp -110.38 110.36 58.08 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.862 177.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -78.22 161.49 29.09 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 123.106 2.538 . . . . 0.0 112.127 177.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.19 -16.65 57.68 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.209 0.528 . . . . 0.0 110.987 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -93.8 -21.41 19.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.163 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -101.04 108.61 20.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.216 0.531 . . . . 0.0 110.064 -179.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 14.2 mt -66.96 131.53 46.06 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.249 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.694 ' HB ' ' O ' ' A' ' 108' ' ' TYR . 17.3 m -117.36 166.95 11.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.995 -175.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.9 111.96 20.39 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.599 ' HB3' HG22 ' A' ' 107' ' ' VAL . 0.0 OUTLIER -110.7 139.84 45.61 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.627 -175.914 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -119.78 -165.11 1.13 Allowed 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.134 179.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.402 ' H ' ' HG3' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -86.01 87.19 7.38 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.909 0.385 . . . . 0.0 110.543 -178.397 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 140.82 -48.03 0.84 Allowed Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.47 176.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -142.59 175.73 9.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.599 0.237 . . . . 0.0 110.383 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.599 HG22 ' HB3' ' A' ' 102' ' ' ARG . 5.0 p -132.6 141.01 46.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.881 -176.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . 0.694 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 1.4 m-85 -120.18 -173.87 2.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.193 175.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.772 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 74.7 m80 -103.91 -157.67 0.62 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 177.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -86.53 -22.29 26.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.008 176.248 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.84 -36.02 15.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.611 -174.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.772 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.62 -17.72 59.02 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.531 -174.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.87 85.35 0.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.766 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.822 HG23 ' HA ' ' A' ' 121' ' ' ARG . 0.6 OUTLIER -143.09 158.44 43.6 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.653 -178.42 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.456 ' HB3' ' H ' ' A' ' 120' ' ' ASN . 42.2 t -62.1 149.76 40.35 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.878 0.37 . . . . 0.0 110.182 175.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 3.5 m -92.68 -14.09 28.54 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.092 0.472 . . . . 0.0 110.579 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.79 -49.6 4.31 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.032 -178.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.09 4.58 13.69 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -174.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 63.9 13.2 7.4 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.466 0.707 . . . . 0.0 112.708 175.062 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . 0.511 HD21 ' HB2' ' A' ' 137' ' ' CYS . 13.4 t30 -63.66 123.86 19.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.816 -178.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.822 ' HA ' HG23 ' A' ' 114' ' ' THR . 0.7 OUTLIER -73.31 116.31 13.71 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.982 0.42 . . . . 0.0 110.894 179.282 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.58 HD21 ' HB2' ' A' ' 128' ' ' PHE . 0.7 OUTLIER -75.04 154.51 37.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.126 -179.506 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.522 HG23 ' CB ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -142.54 146.76 40.03 Favored Pre-proline 0 C--N 1.327 -0.402 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.868 -170.015 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -68.06 111.83 2.56 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.823 2.348 . . . . 0.0 111.768 175.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 113.85 -9.36 23.44 Favored Glycine 0 N--CA 1.448 -0.528 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 -177.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.522 ' CB ' HG23 ' A' ' 123' ' ' VAL . 6.4 t70 -105.42 -145.12 0.38 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 173.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.526 ' HD2' ' OE2' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -133.53 146.7 51.29 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.029 0.442 . . . . 0.0 110.992 179.127 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.58 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -143.1 145.4 32.82 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.458 178.148 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -109.39 126.39 53.38 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.108 0.48 . . . . 0.0 110.518 -178.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.442 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 4.6 t80 -124.2 101.5 7.23 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.549 HD11 HG12 ' A' ' 146' ' ' ILE . 0.5 OUTLIER -122.46 115.56 46.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.253 -178.709 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 12.1 t30 59.65 42.64 16.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.753 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.442 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 67.52 35.83 87.35 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.792 177.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 14.9 m -133.5 135.89 44.73 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 122.606 -0.35 . . . . 0.0 110.121 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 20.6 mt -89.48 120.94 31.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.93 -177.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 -130.11 167.84 17.71 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.442 177.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . 0.511 ' HB2' HD21 ' A' ' 120' ' ' ASN . 4.5 p -132.47 -169.44 2.23 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.076 0.465 . . . . 0.0 111.35 -177.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.526 ' OE2' ' HD2' ' A' ' 127' ' ' ARG . 5.1 mm-40 -72.69 -31.01 64.72 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.572 -173.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -66.24 -43.72 85.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.36 -173.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.453 ' OD2' ' HD3' ' A' ' 142' ' ' PRO . 14.9 p-10 -91.38 -49.85 6.12 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.733 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 41.73 69.56 2.04 Favored Pre-proline 0 N--CA 1.47 0.563 0 O-C-N 123.641 0.588 . . . . 0.0 111.543 178.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . 0.453 ' HD3' ' OD2' ' A' ' 140' ' ' ASP . 32.0 Cg_endo -62.55 92.67 0.14 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.134 2.556 . . . . 0.0 112.756 -174.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.98 6.87 5.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.728 -175.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -87.03 -12.0 48.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.915 172.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.62 -50.64 2.94 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.321 178.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.549 HG12 HD11 ' A' ' 131' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.208 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.442 0 N-CA-C 112.309 -0.316 . . . . 0.0 112.309 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.5 172.13 13.15 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -178.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . 0.436 HD13 ' O ' ' A' ' 126' ' ' ASP . 26.5 mm -84.42 -76.03 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . 179.34 151.67 0.52 Allowed Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.616 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -68.92 -16.27 40.95 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.215 1.943 . . . . 0.0 110.649 172.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 74.15 145.8 0.11 Allowed Pre-proline 0 C--N 1.34 0.158 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.214 177.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.23 115.32 3.6 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.306 2.004 . . . . 0.0 111.76 177.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -134.4 175.08 9.84 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.689 -177.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -100.32 135.58 41.54 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . 0.418 ' HB3' ' H ' ' A' ' 412' ' ' LEU . . . -85.97 -102.99 0.06 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 175.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.458 ' HA ' HD22 ' A' ' 412' ' ' LEU . 17.2 mt -132.3 139.89 36.26 Favored Pre-proline 0 C--N 1.321 -0.655 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 174.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -53.75 133.46 54.32 Favored 'Trans proline' 0 C--O 1.236 0.388 0 C-N-CA 122.783 2.322 . . . . 0.0 112.218 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 5.7 m -58.33 141.39 51.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.518 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.346 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 171.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.628 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.311 0 CA-C-O 121.066 0.46 . . . . 0.0 110.637 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.608 ' HB3' ' HB1' ' A' ' 86' ' ' ALA . 0.4 OUTLIER -108.13 -178.97 3.76 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.035 -174.213 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -80.66 81.65 6.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.727 175.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 114.27 -134.56 11.83 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.774 -0.727 . . . . 0.0 111.315 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -152.29 35.33 0.52 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.125 0.488 . . . . 0.0 110.822 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.489 ' H ' HD11 ' A' ' 80' ' ' LEU . 0.3 OUTLIER -106.62 -113.69 0.27 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.058 -179.613 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . 0.485 ' H ' ' HB2' ' A' ' 84' ' ' SER . . . -88.08 124.76 7.32 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.81 -176.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.608 ' HB1' ' HB3' ' A' ' 80' ' ' LEU . . . -140.16 160.53 39.75 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 177.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.842 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 42.2 t -78.55 145.17 34.98 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.432 0.634 . . . . 0.0 111.288 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.02 -11.51 50.19 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.935 177.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -107.58 -50.36 3.08 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.938 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 28.1 m -82.48 -54.36 5.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.449 0.643 . . . . 0.0 109.736 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.842 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 102.56 -10.37 56.13 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.153 -173.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.05 146.4 52.68 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 176.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.416 ' HB3' HD12 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -65.64 144.31 57.02 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.04 -179.592 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.404 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 5.7 mt -93.72 118.6 67.44 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.237 178.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 94' ' ' ILE . 3.0 Cg_exo -77.21 144.56 23.51 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.998 2.465 . . . . 0.0 112.181 178.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.4 ' HB3' ' HB3' ' A' ' 413' ' ' PRO . . . -77.42 -6.34 53.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.2 0.524 . . . . 0.0 110.604 178.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.41 16.98 25.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.676 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -131.98 162.84 29.73 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.121 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.457 ' HA ' HD23 ' A' ' 99' ' ' LEU . 6.3 mt -106.69 116.06 31.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.167 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.484 ' HB ' ' O ' ' A' ' 108' ' ' TYR . 4.5 m -119.37 150.82 21.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.156 -174.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.51 ' HE3' ' HD2' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -92.51 152.88 19.41 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.316 179.764 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.588 ' HB3' HG12 ' A' ' 107' ' ' VAL . 0.0 OUTLIER -153.9 159.78 41.89 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.855 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -122.4 -162.28 0.99 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.553 -178.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.72 12.08 2.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.163 -178.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -137.34 -81.3 0.1 OUTLIER Glycine 0 N--CA 1.442 -0.935 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.526 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -106.52 175.44 5.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.8 0.333 . . . . 0.0 111.754 -174.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.588 HG12 ' HB3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -108.31 149.83 11.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.126 -177.57 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . 0.484 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 32.2 m-85 -141.77 -168.72 2.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.254 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.765 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 74.6 m80 -110.58 -157.42 0.61 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 172.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -86.17 -23.17 26.63 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.907 0.384 . . . . 0.0 111.266 176.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.41 -36.99 15.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.791 -174.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.765 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -74.58 -13.06 60.61 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.234 -174.375 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . 0.51 ' HD2' ' HE3' ' A' ' 101' ' ' MET . 0.0 OUTLIER -79.23 64.2 4.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.33 0.586 . . . . 0.0 109.996 175.541 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.573 HG23 ' HA ' ' A' ' 121' ' ' ARG . 0.0 OUTLIER -125.17 154.88 40.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.483 -178.612 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 12.5 t -62.91 135.93 57.57 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.258 0.552 . . . . 0.0 110.68 176.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 2.4 m -81.88 -17.5 47.06 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.697 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.32 -51.34 4.63 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -176.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 14.6 p -114.14 -7.09 13.05 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.379 -174.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.41 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 76.76 13.01 2.32 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.001 176.662 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -63.68 118.36 8.16 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 174.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.573 ' HA ' HG23 ' A' ' 114' ' ' THR . 0.6 OUTLIER -66.01 122.68 17.93 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 177.374 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.502 HD22 ' HB2' ' A' ' 128' ' ' PHE . 11.4 mt -68.08 127.22 32.08 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.339 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.489 ' HB ' ' CB ' ' A' ' 126' ' ' ASP . 71.0 t -107.61 134.12 20.14 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -172.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -55.82 109.95 0.49 Allowed 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 122.032 1.821 . . . . 0.0 111.018 175.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.37 6.5 56.58 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.507 -175.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.489 ' CB ' ' HB ' ' A' ' 123' ' ' VAL . 27.3 t0 -121.89 173.94 7.19 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 122.643 -0.328 . . . . 0.0 110.566 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.55 ' HB2' ' HG3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -65.34 140.82 58.7 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.22 0.533 . . . . 0.0 112.335 -176.569 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.615 ' O ' ' HB2' ' A' ' 208' ' ' SER . 0.0 OUTLIER -156.64 170.26 22.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.404 -0.817 . . . . 0.0 108.844 177.516 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -146.16 137.48 24.66 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.692 0.282 . . . . 0.0 110.683 176.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -125.03 100.92 6.8 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 7.1 mm -120.13 104.35 15.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.147 -177.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.1 t30 56.54 55.83 6.13 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.545 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 63.9 33.08 86.28 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.36 -0.837 . . . . 0.0 113.243 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.415 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 1.2 m -131.84 132.83 44.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -178.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 38.2 mt -91.88 116.98 29.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.345 0.593 . . . . 0.0 111.107 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.415 ' CE2' ' HB2' ' A' ' 134' ' ' SER . 61.4 m-85 -128.18 -179.47 5.02 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.238 -0.892 . . . . 0.0 108.712 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . 0.704 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 10.3 p -129.25 -178.91 4.85 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.036 0.446 . . . . 0.0 110.659 176.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.55 ' HG3' ' HB2' ' A' ' 127' ' ' ARG . 1.4 mm-40 -79.13 -14.19 59.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.387 179.073 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . 0.704 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 71.2 t60 -70.97 -47.22 60.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.26 0.552 . . . . 0.0 109.643 -178.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.52 29.73 5.9 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.571 175.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' A' ' 141' ' ' ARG . 14.5 ttp180 -22.64 99.22 0.06 OUTLIER Pre-proline 0 N--CA 1.474 0.725 0 C-N-CA 125.812 1.645 . . . . 0.0 113.9 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -97.55 73.31 0.09 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.449 2.766 . . . . 0.0 112.989 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.41 169.98 8.43 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.142 -0.349 . . . . 0.0 111.247 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . 65.66 -84.21 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.484 0.714 . . . . 0.0 111.206 178.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -93.05 20.82 6.36 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 176.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 5.7 mt . . . . . 0 C--O 1.233 0.204 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.738 -171.855 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.486 0 N-CA-C 114.385 0.514 . . . . 0.0 114.385 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 208' ' ' SER . . . . . 0.615 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 68.7 m -156.45 138.3 14.33 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 171.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 46.5 mm -118.89 137.08 54.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.539 0.209 . . . . 0.0 110.576 -174.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . 0.468 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -75.23 134.48 73.87 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.125 -178.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 14.7 Cg_exo -70.3 -178.67 2.67 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 123.482 2.788 . . . . 0.0 112.458 177.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -97.95 157.92 33.75 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.333 -177.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . 0.442 ' HB3' ' SD ' ' A' ' 101' ' ' MET . 97.1 Cg_endo -87.51 121.04 1.55 Allowed 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.719 2.279 . . . . 0.0 112.054 172.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.99 178.08 7.39 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.297 178.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -62.25 149.75 41.02 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.095 0.474 . . . . 0.0 111.458 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . 0.429 ' HB3' ' H ' ' A' ' 412' ' ' LEU . . . -136.32 -145.23 0.21 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.575 179.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.429 ' H ' ' HB3' ' A' ' 411' ' ' ALA . 4.4 tp -73.01 128.18 88.3 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.733 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . 0.4 ' HB3' ' HB3' ' A' ' 96' ' ' ALA . 9.9 Cg_exo -72.17 168.96 22.67 Favored 'Trans proline' 0 CA--C 1.532 0.4 0 C-N-CA 123.095 2.53 . . . . 0.0 113.668 -175.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 90.8 m -92.49 133.08 36.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.594 178.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 69.4 m . . . . . 0 CA--C 1.533 0.294 0 O-C-N 123.329 0.393 . . . . 0.0 111.255 179.576 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.787 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 39.1 ttp180 . . . . . 0 CA--C 1.518 -0.254 0 CA-C-O 121.481 0.657 . . . . 0.0 110.784 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.459 ' H ' ' HG ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -82.15 127.02 32.72 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.348 178.13 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -66.83 105.17 1.51 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.473 ' O ' ' HB2' ' A' ' 83' ' ' ASN . . . 94.93 -94.26 1.73 Allowed Glycine 0 N--CA 1.442 -0.964 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 -172.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.473 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 5.0 t-20 170.24 167.48 0.06 Allowed 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 177.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.7 m 71.03 -60.94 0.5 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 172.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.69 71.86 2.64 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.37 -172.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -148.18 170.78 17.11 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 122.293 0.237 . . . . 0.0 110.381 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.81 145.78 30.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.999 0.428 . . . . 0.0 110.231 -179.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.37 -8.31 55.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.542 -172.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.582 ' CB ' ' HB3' ' A' ' 112' ' ' CYS . . . -88.65 -54.11 4.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.642 0.258 . . . . 0.0 111.453 -176.187 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 31.5 p -98.28 -39.84 8.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.063 0.459 . . . . 0.0 110.509 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.787 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 96.77 8.74 56.91 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-N 115.652 -0.703 . . . . 0.0 112.223 -178.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.516 ' HA ' HE21 ' A' ' 92' ' ' GLN . 1.1 tp60 -89.24 155.62 19.28 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.781 0.324 . . . . 0.0 110.321 177.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.51 ' HB3' ' HB ' ' A' ' 414' ' ' THR . 13.9 m -71.39 160.27 33.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.472 -174.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.479 HG23 HG11 ' A' ' 100' ' ' VAL . 23.3 mt -101.14 111.23 63.2 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.219 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.73 148.0 22.31 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 123.021 2.481 . . . . 0.0 111.3 172.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.94 -11.78 61.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.037 0.446 . . . . 0.0 111.594 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.85 1.0 57.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.26 0.552 . . . . 0.0 110.797 179.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.07 175.38 5.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.912 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.628 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 32.0 mt -124.11 133.17 53.67 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.694 0.283 . . . . 0.0 110.337 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.625 HG21 ' O ' ' A' ' 409' ' ' GLU . 0.0 OUTLIER -115.96 142.29 29.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.364 0.602 . . . . 0.0 110.6 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 5.1 mmt -85.56 113.98 22.22 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.788 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -99.44 121.93 41.83 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.203 -178.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -104.71 -83.34 0.5 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.769 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -123.64 60.2 1.1 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.24 0.543 . . . . 0.0 110.279 -179.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.65 -17.37 45.12 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.105 -179.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . 0.422 ' ND2' ' HH ' ' A' ' 130' ' ' TYR . 0.3 OUTLIER -92.38 157.94 16.34 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 177.605 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -131.81 144.01 38.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.994 0.426 . . . . 0.0 111.745 -175.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -138.7 165.96 25.61 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 175.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.824 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 30.6 m80 -87.44 168.92 12.68 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.482 178.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.456 HD23 ' HA ' ' A' ' 110' ' ' LEU . 0.4 OUTLIER -62.58 -31.22 72.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.247 0.546 . . . . 0.0 110.983 177.906 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.48 -20.78 23.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.905 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.824 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 35.3 m -91.27 -4.13 56.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.624 -174.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . 0.558 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.1 OUTLIER -85.16 91.83 8.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.952 0.406 . . . . 0.0 110.553 178.025 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -146.43 156.19 43.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.237 -177.288 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.535 ' HB2' ' HB3' ' A' ' 137' ' ' CYS . 0.0 OUTLIER -70.82 152.64 43.52 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 169.501 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 1.4 p -93.21 -22.01 19.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -174.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.2 -51.05 4.56 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -172.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.698 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -101.57 -8.69 21.65 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.525 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.4 OUTLIER 62.78 44.75 6.21 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.429 -179.772 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . 0.449 ' H ' ' HB3' ' A' ' 115' ' ' CYS . 44.3 t30 -80.44 118.55 22.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.597 176.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -69.58 108.04 3.66 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 177.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.458 ' H ' ' HG ' ' A' ' 122' ' ' LEU . 0.6 OUTLIER -70.8 129.06 38.11 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.688 -179.669 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.2 t -145.26 146.71 31.37 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.778 -173.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.79 111.69 0.76 Allowed 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.63 2.22 . . . . 0.0 111.635 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.22 -19.77 13.09 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.338 -0.705 . . . . 0.0 111.338 -176.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.451 ' CG ' ' H ' ' A' ' 127' ' ' ARG . 9.6 t70 -101.93 -152.82 0.44 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.451 ' H ' ' CG ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -121.56 155.19 35.55 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.765 0.317 . . . . 0.0 110.815 -174.2 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.541 ' CE2' ' HB2' ' A' ' 130' ' ' TYR . 0.2 OUTLIER -157.61 143.31 17.31 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.655 174.3 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . 0.496 ' HE2' ' CD ' ' A' ' 138' ' ' GLU . 51.7 m-70 -121.33 122.81 40.67 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.831 0.348 . . . . 0.0 110.078 178.288 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.541 ' HB2' ' CE2' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -119.82 101.77 8.11 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 178.813 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 1.5 mt -108.52 103.21 15.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.13 -178.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.1 t30 58.17 28.5 16.58 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.803 177.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.404 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 92.75 30.17 9.93 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.775 -179.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -125.9 126.63 44.72 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 176.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 14.6 mt -91.66 115.7 28.27 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -174.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -136.38 179.01 6.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.461 176.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . 0.64 ' SG ' ' HB2' ' A' ' 139' ' ' HIS . 1.1 p -137.84 179.19 6.57 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.719 0.295 . . . . 0.0 110.792 176.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.496 ' CD ' ' HE2' ' A' ' 129' ' ' HIS . 6.8 mm-40 -73.72 -16.07 61.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.284 -176.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . 0.64 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 0.2 OUTLIER -78.43 -11.07 59.93 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.698 0.285 . . . . 0.0 110.885 -176.644 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.698 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 10.4 p-10 -127.82 -47.37 1.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.225 177.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . 0.77 ' HG2' HD13 ' A' ' 146' ' ' ILE . 0.0 OUTLIER 46.77 68.43 3.47 Favored Pre-proline 0 N--CA 1.47 0.569 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 172.89 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . 0.444 ' HD3' ' OD2' ' A' ' 140' ' ' ASP . 66.1 Cg_endo -94.6 -172.99 0.29 Allowed 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 122.884 2.389 . . . . 0.0 112.837 178.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' THR . . . . . 0.46 ' C ' ' H ' ' A' ' 145' ' ' LEU . 5.8 m 75.26 121.83 0.04 OUTLIER 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.226 -176.525 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -75.5 39.95 0.17 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.148 0.499 . . . . 0.0 111.023 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.46 ' H ' ' C ' ' A' ' 143' ' ' THR . 1.9 mt -162.69 27.06 0.1 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.093 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.77 HD13 ' HG2' ' A' ' 141' ' ' ARG . 3.0 tt . . . . . 0 C--N 1.327 -0.384 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.088 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.465 0 N-CA-C 111.897 -0.481 . . . . 0.0 111.897 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 40.6 m -155.52 136.16 13.42 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.941 0.4 . . . . 0.0 110.582 177.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . 0.445 HG22 HD11 ' A' ' 404' ' ' ILE . 15.0 mm -93.85 136.16 26.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.232 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . 0.471 ' HA ' ' CD1' ' A' ' 128' ' ' PHE . . . -60.72 143.0 91.41 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.311 -178.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . 0.558 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 71.9 Cg_endo -74.68 -164.35 0.22 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.723 2.282 . . . . 0.0 112.541 179.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -117.07 146.07 37.17 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.086 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . 0.628 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 74.1 Cg_endo -77.1 125.52 7.98 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 122.551 2.167 . . . . 0.0 112.267 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . 0.625 ' O ' HG21 ' A' ' 100' ' ' VAL . 2.3 mt-10 -130.33 152.75 49.4 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.55 178.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -77.1 110.68 11.96 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.085 0.469 . . . . 0.0 110.376 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -93.85 -135.52 0.18 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.074 -178.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.401 ' H ' ' HG ' ' A' ' 412' ' ' LEU . 0.1 OUTLIER -81.22 129.26 67.52 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 179.508 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -78.83 164.98 24.97 Favored 'Trans proline' 0 C--O 1.237 0.47 0 C-N-CA 122.654 2.236 . . . . 0.0 112.586 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 414' ' ' THR . . . . . 0.51 ' HB ' ' HB3' ' A' ' 93' ' ' SER . 4.1 t -75.55 164.7 26.07 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.972 179.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.635 177.092 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.1 0 CA-C-O 120.955 0.407 . . . . 0.0 110.163 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.513 ' HB3' ' HA ' ' A' ' 83' ' ' ASN . 0.3 OUTLIER -162.58 158.23 23.11 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.096 -179.414 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -62.59 -63.77 1.12 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.082 178.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -96.85 9.46 65.99 Favored Glycine 0 C--O 1.229 -0.19 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.402 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.513 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 5.2 t-20 61.01 94.49 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.482 0.658 . . . . 0.0 111.958 -178.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -146.82 -146.15 0.19 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 177.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.54 108.78 2.67 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.457 -0.878 . . . . 0.0 111.97 176.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.466 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -110.52 150.57 28.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.815 0.341 . . . . 0.0 111.381 -176.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.416 ' SG ' ' HB1' ' A' ' 89' ' ' ALA . 0.0 OUTLIER -73.39 128.57 35.87 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 175.286 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.59 -5.39 47.54 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.638 -172.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.479 ' CB ' ' HB3' ' A' ' 112' ' ' CYS . . . -84.64 -46.93 11.02 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 121.039 -0.264 . . . . 0.0 110.738 -177.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.544 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 31.2 p -110.18 -74.65 0.64 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.192 -178.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.544 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 134.81 7.07 2.14 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 111.476 -0.649 . . . . 0.0 111.476 -176.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -73.88 131.45 41.5 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.059 0.457 . . . . 0.0 110.436 178.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.506 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 1.4 m -69.03 121.18 16.13 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.839 175.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.603 HG12 HG13 ' A' ' 100' ' ' VAL . 2.6 mp -74.89 113.52 25.51 Favored Pre-proline 0 C--N 1.326 -0.427 0 O-C-N 123.62 0.575 . . . . 0.0 112.287 -172.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.506 ' HD3' ' O ' ' A' ' 93' ' ' SER . 5.6 Cg_exo -80.56 167.49 18.93 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 123.407 2.738 . . . . 0.0 110.879 167.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.68 -1.47 24.93 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.056 0.455 . . . . 0.0 111.063 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.62 -29.09 22.82 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.071 178.258 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -85.97 173.89 9.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.502 -178.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.455 ' HB2' HD22 ' A' ' 110' ' ' LEU . 25.5 mt -125.73 128.77 48.28 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.592 -178.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.603 HG13 HG12 ' A' ' 94' ' ' ILE . 0.0 OUTLIER -126.08 147.74 30.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.99 179.414 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.468 ' HE3' ' HD2' ' A' ' 113' ' ' PHE . 1.9 mtt -105.14 155.55 18.91 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.44 177.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 93.0 mtm-85 -112.6 98.69 7.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.677 0.275 . . . . 0.0 110.331 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -79.95 -36.36 36.31 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.121 0.486 . . . . 0.0 110.42 178.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.415 ' HB2' ' H ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -152.63 -127.45 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.675 178.69 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.415 ' H ' ' HB2' ' A' ' 104' ' ' GLN . . . -78.08 -26.31 60.28 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.741 -0.742 . . . . 0.0 111.853 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -103.27 162.31 13.1 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.937 0.399 . . . . 0.0 110.297 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 2.4 m -103.39 160.56 4.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.423 -176.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -137.29 143.1 41.98 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.625 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 7.6 m80 -69.27 161.87 28.36 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.871 0.367 . . . . 0.0 111.581 -177.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.455 HD22 ' HB2' ' A' ' 99' ' ' LEU . 0.3 OUTLIER -67.34 -27.63 67.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.231 0.538 . . . . 0.0 109.99 173.226 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.6 -23.19 22.01 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.738 178.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.625 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 63.6 m -94.77 -18.71 21.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.379 -176.244 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . 0.468 ' HD2' ' HE3' ' A' ' 101' ' ' MET . 0.0 OUTLIER -67.5 82.75 0.16 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.578 0.704 . . . . 0.0 110.508 177.029 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.751 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.5 p -135.47 160.99 36.73 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.693 -178.015 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.436 ' SG ' ' N ' ' A' ' 119' ' ' ARG . 26.2 p -72.73 149.94 43.3 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.349 0.595 . . . . 0.0 111.078 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.77 -2.27 58.51 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.455 179.232 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.559 ' HB ' ' SG ' ' A' ' 118' ' ' CYS . 0.8 OUTLIER -90.41 -54.68 3.9 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.65 -177.884 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.667 ' SG ' ' HB2' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -123.75 -20.9 5.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.231 -172.481 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.436 ' N ' ' SG ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 81.02 50.97 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 123.812 0.845 . . . . 0.0 111.288 -179.289 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -97.32 151.65 19.69 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 169.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.751 ' HA ' HG22 ' A' ' 114' ' ' THR . 1.1 ttm180 -86.15 130.14 34.62 Favored 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.005 -176.297 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.486 HD12 ' HB2' ' A' ' 128' ' ' PHE . 16.0 mt -77.25 158.42 30.27 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 173.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -134.39 139.12 31.83 Favored Pre-proline 0 C--N 1.325 -0.476 0 C-N-CA 119.967 -0.693 . . . . 0.0 111.35 -169.046 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . 0.406 ' HB3' ' HD3' ' A' ' 408' ' ' PRO . 11.7 Cg_endo -55.68 121.63 10.3 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 123.075 2.516 . . . . 0.0 111.874 177.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 91.0 -2.06 78.81 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.438 -0.887 . . . . 0.0 112.331 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -112.26 -179.2 3.61 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 177.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.805 ' HG2' HD13 ' A' ' 404' ' ' ILE . 1.3 mtt85 -88.78 149.14 23.57 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.417 0.627 . . . . 0.0 112.314 -171.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.486 ' HB2' HD12 ' A' ' 122' ' ' LEU . 0.6 OUTLIER -148.91 145.58 27.48 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 175.721 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . 0.523 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 60.8 m-70 -115.31 121.65 43.52 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.76 0.314 . . . . 0.0 110.915 -175.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.498 ' HD1' HD21 ' A' ' 135' ' ' LEU . 1.4 t80 -112.58 100.78 8.99 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 174.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.496 HD12 ' HB3' ' A' ' 129' ' ' HIS . 8.4 mt -124.04 124.01 67.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.198 -175.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 61.1 33.96 19.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.237 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 69.39 35.1 75.4 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.869 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.49 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.8 OUTLIER -131.67 154.24 49.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.798 0.299 . . . . 0.0 110.359 -178.046 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.498 HD21 ' HD1' ' A' ' 130' ' ' TYR . 13.2 mt -96.54 114.59 26.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.497 -177.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.523 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 30.9 m-85 -120.43 157.26 29.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.343 0.592 . . . . 0.0 110.414 179.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . 0.542 ' HB2' ' H ' ' A' ' 140' ' ' ASP . 0.5 OUTLIER -92.55 152.41 19.64 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.921 -175.233 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.425 ' OE1' ' HD2' ' A' ' 127' ' ' ARG . 16.8 tp10 -80.37 -24.83 39.5 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.731 0.776 . . . . 0.0 108.909 161.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -81.54 -52.55 7.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.931 -171.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.667 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -114.94 34.39 4.86 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -178.322 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . 0.446 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 9.9 ttp-105 -48.4 129.38 13.23 Favored Pre-proline 0 N--CA 1.464 0.27 0 CA-C-N 114.323 -1.308 . . . . 0.0 112.511 -173.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 21.2 Cg_exo -66.03 141.4 63.92 Favored 'Trans proline' 0 C--O 1.235 0.358 0 C-N-CA 122.829 2.353 . . . . 0.0 112.086 178.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.11 -3.9 57.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.558 -179.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -97.55 -74.14 0.58 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.808 -176.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' A' ' 145' ' ' LEU . 0.0 OUTLIER -84.12 85.77 7.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.922 0.392 . . . . 0.0 111.08 -176.159 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.326 -0.433 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.991 176.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.684 0 N-CA-C 112.183 -0.367 . . . . 0.0 112.183 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.43 -176.15 2.91 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.137 0.494 . . . . 0.0 111.316 -176.185 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . 0.805 HD13 ' HG2' ' A' ' 127' ' ' ARG . 10.7 mm -111.38 135.54 50.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 176.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -59.5 113.21 6.53 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 177.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . 0.469 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 83.7 Cg_exo -45.64 -72.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.655 2.904 . . . . 0.0 112.819 -172.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . 0.469 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 1.1 t80 168.95 139.28 0.05 OUTLIER Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.147 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . 0.429 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 73.1 Cg_endo -85.87 107.13 0.9 Allowed 'Trans proline' 0 N--CA 1.446 -1.323 0 C-N-CA 122.22 1.947 . . . . 0.0 110.907 171.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -129.81 168.98 15.74 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.428 -175.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -77.22 111.12 12.51 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.203 177.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -89.2 -168.63 2.23 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.966 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.478 ' H ' ' HG ' ' A' ' 412' ' ' LEU . 0.1 OUTLIER -64.68 121.17 71.71 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.27 179.408 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -57.26 127.48 25.77 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.773 2.315 . . . . 0.0 111.815 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 34.0 p -85.3 161.13 19.65 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.567 -175.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 CA--C 1.532 0.271 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.038 -179.392 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 48.1 ttt85 . . . . . 0 CA--C 1.521 -0.164 0 CA-C-O 121.141 0.496 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.927 ' HG ' ' HB1' ' A' ' 86' ' ' ALA . 6.5 mp -83.97 10.76 9.07 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.586 -175.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.722 ' HB2' ' HG ' ' A' ' 93' ' ' SER . 0.3 OUTLIER 49.28 84.48 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.558 0 O-C-N 123.803 0.69 . . . . 0.0 111.805 177.039 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.08 -16.98 19.35 Favored Glycine 0 C--O 1.228 -0.253 0 C-N-CA 120.306 -0.95 . . . . 0.0 111.083 -174.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.665 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 1.8 t30 71.11 54.39 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 123.654 0.781 . . . . 0.0 111.3 175.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.68 -58.44 1.88 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.565 177.215 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -155.38 142.82 9.23 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.615 -0.803 . . . . 0.0 112.382 -178.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.927 ' HB1' ' HG ' ' A' ' 80' ' ' LEU . . . -154.24 171.11 19.74 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.53 ' HB2' ' HA ' ' A' ' 108' ' ' TYR . 0.1 OUTLIER -95.76 145.04 25.63 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.1 m -82.01 6.37 16.35 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -174.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.602 ' HB1' ' HB3' ' A' ' 112' ' ' CYS . . . -96.98 -59.59 1.76 Allowed 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.86 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.442 ' HB3' ' HZ3' ' A' ' 111' ' ' LYS . 19.8 p -92.72 -36.76 12.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.85 0.357 . . . . 0.0 110.108 178.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 98.04 -3.37 60.29 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.487 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.434 ' HB2' ' SG ' ' A' ' 90' ' ' CYS . 0.0 OUTLIER -81.18 159.14 24.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.937 0.398 . . . . 0.0 110.612 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.722 ' HG ' ' HB2' ' A' ' 81' ' ' PHE . 0.0 OUTLIER -67.24 164.82 17.45 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.651 -173.794 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.5 mt -113.83 99.83 50.97 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.807 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -77.04 159.68 33.79 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.589 2.193 . . . . 0.0 111.243 174.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -70.07 -10.07 57.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.132 0.491 . . . . 0.0 111.125 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.51 -13.32 52.21 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.002 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -117.25 147.78 42.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.977 -178.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.607 ' HB2' ' HB2' ' A' ' 408' ' ' PRO . 1.0 OUTLIER -108.43 141.6 40.05 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.857 -179.657 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -115.59 139.66 40.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.139 0.495 . . . . 0.0 111.125 -177.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.576 ' HE1' ' CD2' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -85.19 122.1 28.89 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.659 177.312 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.469 HH21 ' CD ' ' A' ' 409' ' ' GLU . 0.0 OUTLIER -113.75 142.16 46.39 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.219 -178.649 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -118.48 -76.54 0.57 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.531 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.414 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 0.2 OUTLIER -90.64 -93.64 0.13 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.145 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.414 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -120.16 0.16 13.01 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.4 175.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -103.07 163.67 12.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.746 0.307 . . . . 0.0 110.821 -177.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.2 m -134.91 148.12 29.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.329 -178.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . 0.53 ' HA ' ' HB2' ' A' ' 87' ' ' CYS . 6.1 m-85 -138.67 146.59 41.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.68 177.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.928 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 54.2 m80 -72.33 168.74 17.73 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.409 HD23 ' HG3' ' A' ' 408' ' ' PRO . 0.3 OUTLIER -63.02 -31.85 73.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.207 0.527 . . . . 0.0 110.939 178.887 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.465 ' HG3' ' SG ' ' A' ' 112' ' ' CYS . 3.4 pttp -89.35 0.65 56.66 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.05 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.928 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 4.6 m -117.41 -10.1 10.76 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.557 -176.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . 0.576 ' CD2' ' HE1' ' A' ' 101' ' ' MET . 0.1 OUTLIER -75.6 69.68 2.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.549 0.69 . . . . 0.0 110.251 176.517 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.706 HG23 ' HA ' ' A' ' 121' ' ' ARG . 19.7 p -138.71 153.45 48.51 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.152 -0.931 . . . . 0.0 109.425 -178.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.484 ' HB3' ' HA ' ' A' ' 136' ' ' PHE . 3.6 p -71.89 153.2 42.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.059 0.457 . . . . 0.0 110.673 179.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -84.15 -8.02 59.2 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.063 0.459 . . . . 0.0 110.727 178.036 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.16 -51.11 5.76 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.925 -178.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.61 -6.45 10.19 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.487 -177.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.453 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 61.78 35.86 16.51 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.063 0.459 . . . . 0.0 110.551 -179.272 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . 0.586 HD21 ' HB2' ' A' ' 137' ' ' CYS . 49.2 t30 -80.95 131.61 35.34 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.643 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.706 ' HA ' HG23 ' A' ' 114' ' ' THR . 1.1 tpp85 -72.65 115.42 11.9 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.97 -178.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.449 HD11 ' HD2' ' A' ' 128' ' ' PHE . 5.6 mt -74.97 139.62 43.09 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 177.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -131.28 133.23 24.29 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-O 120.704 0.287 . . . . 0.0 111.603 -169.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -60.9 113.23 1.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.481 2.12 . . . . 0.0 110.538 171.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 120.21 -22.59 8.4 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 110.748 -0.941 . . . . 0.0 110.748 -173.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.01 -175.46 2.69 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.408 ' HB3' ' HG2' ' A' ' 138' ' ' GLU . 8.7 ttm-85 -99.07 148.37 24.11 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.849 0.357 . . . . 0.0 111.159 -173.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.449 ' HD2' HD11 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -143.2 156.76 44.83 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.508 176.366 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . 0.551 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 4.6 m-70 -117.39 117.89 30.72 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.001 0.429 . . . . 0.0 110.517 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.453 ' HA ' ' O ' ' A' ' 134' ' ' SER . 16.3 t80 -118.75 101.67 8.26 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 176.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -124.62 113.75 37.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.574 -177.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 7.0 t30 56.67 41.07 28.87 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.226 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 75.04 33.48 54.65 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.748 -0.739 . . . . 0.0 113.019 177.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.453 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.6 OUTLIER -126.98 145.45 50.7 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.828 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.408 ' HA ' HD21 ' A' ' 135' ' ' LEU . 79.1 mt -101.35 124.46 47.07 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.339 0.399 . . . . 0.0 110.967 -176.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.551 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 76.4 m-85 -135.95 164.4 28.06 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.613 175.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . 0.586 ' HB2' HD21 ' A' ' 120' ' ' ASN . 30.9 p -113.55 -167.23 1.17 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.28 0.562 . . . . 0.0 111.844 -175.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.408 ' HG2' ' HB3' ' A' ' 127' ' ' ARG . 1.3 mt-10 -75.36 -30.08 60.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.261 176.147 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . 0.465 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 77.6 t60 -73.84 -30.87 62.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.113 177.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.523 ' HB3' ' HD3' ' A' ' 142' ' ' PRO . 0.9 OUTLIER -66.47 -80.89 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.095 175.182 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 48.97 59.65 16.78 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.362 -177.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . 0.523 ' HD3' ' HB3' ' A' ' 140' ' ' ASP . 37.6 Cg_endo -66.01 92.37 0.26 Allowed 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.849 2.366 . . . . 0.0 112.03 -175.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' THR . . . . . 0.426 ' HA ' HG12 ' A' ' 146' ' ' ILE . 0.2 OUTLIER -76.23 58.86 1.31 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.371 -178.529 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -125.68 -65.88 0.97 Allowed 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.469 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -115.73 43.06 2.17 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.076 0.465 . . . . 0.0 110.266 179.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.426 HG12 ' HA ' ' A' ' 143' ' ' THR . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.833 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.528 0 N-CA-C 111.634 -0.586 . . . . 0.0 111.634 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.62 167.42 11.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.92 0.39 . . . . 0.0 110.686 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 46.9 mm -76.19 130.14 36.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -56.67 130.77 77.71 Favored Pre-proline 0 C--N 1.33 -0.247 0 O-C-N 123.337 0.398 . . . . 0.0 111.346 -177.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.78 162.07 30.01 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.851 2.368 . . . . 0.0 112.169 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -88.45 152.69 50.05 Favored Pre-proline 0 C--N 1.319 -0.758 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.043 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . 0.607 ' HB2' ' HB2' ' A' ' 99' ' ' LEU . 51.2 Cg_endo -70.27 126.62 13.17 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 122.161 1.907 . . . . 0.0 111.758 176.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . 0.469 ' CD ' HH21 ' A' ' 102' ' ' ARG . 2.6 mt-10 -127.0 160.7 30.32 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.465 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -79.5 123.52 27.64 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.651 -0.499 . . . . 0.0 109.651 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -103.38 -106.3 0.28 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.22 -177.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.78 117.23 37.8 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.42 131.94 26.07 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.578 2.186 . . . . 0.0 112.773 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 414' ' ' THR . . . . . 0.47 HG21 ' N ' ' A' ' 415' ' ' SER . 19.2 m -56.36 142.0 39.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.045 -0.98 . . . . 0.0 111.084 174.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 415' ' ' SER . . . . . 0.47 ' N ' HG21 ' A' ' 414' ' ' THR . 11.1 m . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.107 -176.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.8 mtp85 . . . . . 0 N--CA 1.461 0.122 0 CA-C-O 121.279 0.562 . . . . 0.0 109.954 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.821 ' HB3' ' HB3' ' A' ' 86' ' ' ALA . 1.4 pt? -121.01 -179.43 4.02 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.494 -169.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.491 ' O ' HG21 ' A' ' 414' ' ' THR . 77.3 m-85 -105.81 141.81 36.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.224 175.112 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.64 -40.95 2.99 Favored Glycine 0 CA--C 1.517 0.2 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.616 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.482 ' HA ' HD23 ' A' ' 80' ' ' LEU . 2.3 t-20 81.75 33.76 0.1 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.637 0.775 . . . . 0.0 112.198 175.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.401 ' N ' HD11 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -130.25 66.99 1.48 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.282 177.032 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 117.65 98.18 1.95 Allowed Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.459 -0.877 . . . . 0.0 113.093 175.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.821 ' HB3' ' HB3' ' A' ' 80' ' ' LEU . . . -138.33 156.47 47.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.144 0.497 . . . . 0.0 110.838 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 4.6 t -70.4 146.57 50.31 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.392 178.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.94 8.54 39.36 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.525 172.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -120.94 -59.62 1.72 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.453 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.487 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 30.3 p -93.09 -77.61 0.44 Allowed 'General case' 0 C--O 1.233 0.207 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.541 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.487 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 145.84 -3.03 1.08 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.642 -0.789 . . . . 0.0 113.142 176.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.9 tp60 -63.89 128.39 35.59 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 117.275 0.538 . . . . 0.0 110.616 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.429 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 0.7 OUTLIER -56.34 120.79 8.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.804 -0.634 . . . . 0.0 109.54 172.389 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.479 HD12 HG12 ' A' ' 100' ' ' VAL . 5.1 mt -75.89 113.39 26.83 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 112.224 0.454 . . . . 0.0 112.224 -172.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.677 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 5.7 Cg_exo -78.19 167.68 22.9 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.373 2.715 . . . . 0.0 111.083 172.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.19 -2.87 26.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.86 0.362 . . . . 0.0 111.16 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.93 8.38 34.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.954 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.677 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 1.6 mm-40 -119.03 134.54 55.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.885 177.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.518 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 1.4 mt -100.82 136.63 40.37 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.061 0.458 . . . . 0.0 110.342 -178.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.479 HG12 HD12 ' A' ' 94' ' ' ILE . 1.6 m -115.37 136.5 51.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.718 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.466 ' SD ' ' HG3' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -84.26 123.42 30.12 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.068 -179.446 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 13.2 ptt85 -90.24 121.46 32.28 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.103 -177.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -105.13 -27.35 11.65 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.922 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -179.41 -128.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.811 -178.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -78.33 -8.29 87.57 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.567 -0.825 . . . . 0.0 111.252 173.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 28.5 m-20 -102.93 142.05 34.7 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 177.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -126.49 141.54 45.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.005 0.431 . . . . 0.0 110.896 -177.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -129.29 172.77 11.15 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 177.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.79 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 13.9 m80 -85.17 170.73 12.59 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 177.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.425 HD13 ' HD3' ' A' ' 111' ' ' LYS . 0.3 OUTLIER -69.63 -23.54 63.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.32 0.581 . . . . 0.0 109.521 173.578 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.46 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.25 -18.75 25.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.409 176.469 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.79 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 55.6 m -100.78 7.39 43.81 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.241 0.543 . . . . 0.0 111.06 -176.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . 0.443 ' HD1' ' HA ' ' A' ' 113' ' ' PHE . 0.1 OUTLIER -89.69 73.06 7.68 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.3 0.571 . . . . 0.0 110.273 177.84 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.782 HG22 ' HA ' ' A' ' 121' ' ' ARG . 15.2 p -133.48 155.7 49.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.145 -179.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 26.8 p -73.21 153.49 40.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.048 0.451 . . . . 0.0 110.816 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.49 2.16 42.3 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.977 -176.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -109.05 -51.63 2.86 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -179.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.95 -10.5 13.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.899 0.381 . . . . 0.0 110.941 -177.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 58.84 35.53 24.28 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.201 -177.006 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -73.87 120.8 19.96 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 174.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.782 ' HA ' HG22 ' A' ' 114' ' ' THR . 3.6 ttm180 -66.83 124.91 24.25 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.986 0.422 . . . . 0.0 110.749 -178.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.741 HD22 ' HB2' ' A' ' 128' ' ' PHE . 1.7 mt -76.75 158.91 30.58 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.138 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.522 ' O ' ' HB3' ' A' ' 405' ' ' ALA . 71.9 t -126.51 132.12 24.19 Favored Pre-proline 0 C--N 1.327 -0.41 0 C-N-CA 121.096 -0.241 . . . . 0.0 110.415 -172.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . 0.422 ' HG3' ' HE1' ' A' ' 101' ' ' MET . 32.1 Cg_exo -59.06 111.39 0.89 Allowed 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.705 2.27 . . . . 0.0 111.096 175.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 93.49 17.09 43.53 Favored Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 120.568 -0.825 . . . . 0.0 111.793 -177.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -133.8 -176.17 4.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.815 0.34 . . . . 0.0 111.031 176.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -75.35 127.12 32.43 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.439 -172.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.741 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -145.62 165.72 27.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 172.593 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . 0.511 ' HB3' ' HB2' ' A' ' 136' ' ' PHE . 0.6 OUTLIER -131.19 128.67 40.46 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.719 -0.613 . . . . 0.0 111.822 -178.194 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.462 ' HB2' ' CZ ' ' A' ' 128' ' ' PHE . 1.7 t80 -125.58 101.07 6.73 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.063 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.52 HD12 HG13 ' A' ' 146' ' ' ILE . 56.2 mt -110.22 103.81 16.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.192 -177.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.7 t30 53.64 38.91 29.38 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.686 0.617 . . . . 0.0 111.262 -178.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 85.63 21.46 53.64 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.65 -0.786 . . . . 0.0 113.297 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -113.76 134.06 54.99 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 117.201 0.501 . . . . 0.0 109.769 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 14.5 mt -88.64 115.25 26.03 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.937 0.399 . . . . 0.0 111.23 -176.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.511 ' HB2' ' HB3' ' A' ' 129' ' ' HIS . 63.9 m-85 -131.09 168.18 17.85 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.554 176.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . 0.577 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 24.9 p -113.78 -169.65 1.55 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.204 0.525 . . . . 0.0 110.854 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.65 -28.97 51.43 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.99 177.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -77.83 -28.28 50.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.493 0.663 . . . . 0.0 109.517 178.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.577 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.4 OUTLIER -67.18 -82.15 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.313 174.657 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 42.46 73.33 0.94 Allowed Pre-proline 0 C--O 1.237 0.438 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.964 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . 0.542 ' O ' ' HB ' ' A' ' 146' ' ' ILE . 50.4 Cg_exo -55.41 100.91 0.08 OUTLIER 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.758 2.305 . . . . 0.0 111.711 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.61 56.49 3.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.825 -173.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -158.72 -78.1 0.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.558 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.51 ' HA ' HD22 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -89.01 71.73 8.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.436 0.636 . . . . 0.0 109.562 175.576 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.542 ' HB ' ' O ' ' A' ' 142' ' ' PRO . 11.5 tt . . . . . 0 C--N 1.321 -0.662 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.234 -176.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.936 0 N-CA-C 112.183 -0.367 . . . . 0.0 112.183 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -113.61 134.19 54.86 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.917 0.389 . . . . 0.0 110.2 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 38.5 mm -79.27 117.99 25.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 176.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . 0.522 ' HB3' ' O ' ' A' ' 123' ' ' VAL . . . -59.94 132.79 89.61 Favored Pre-proline 0 C--O 1.235 0.34 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.321 -175.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . 0.508 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 2.8 Cg_exo -76.65 -170.81 0.96 Allowed 'Trans proline' 0 N--CA 1.462 -0.364 0 C-N-CA 123.663 2.909 . . . . 0.0 112.414 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -104.73 158.36 32.16 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.269 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . 0.518 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 5.8 Cg_exo -77.62 141.4 19.65 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.778 2.318 . . . . 0.0 112.086 178.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.32 177.28 7.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.291 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -104.28 121.1 42.63 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 178.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -84.8 -102.94 0.05 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.219 -178.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -131.74 130.89 22.44 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -68.01 145.33 67.27 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.132 1.888 . . . . 0.0 111.658 176.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 414' ' ' THR . . . . . 0.491 HG21 ' O ' ' A' ' 81' ' ' PHE . 0.1 OUTLIER -76.19 178.1 6.68 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.055 -176.196 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.301 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.099 178.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.608 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.117 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.689 HD21 ' HB ' ' A' ' 414' ' ' THR . 0.5 OUTLIER -144.76 -179.97 6.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.948 0.404 . . . . 0.0 111.281 -177.847 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -92.15 -60.56 1.82 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.219 177.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.521 ' HA3' ' HA ' ' A' ' 415' ' ' SER . . . -87.19 -1.89 83.82 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.185 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 60.92 93.42 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.342 0.591 . . . . 0.0 111.923 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.482 ' HB2' HG23 ' A' ' 414' ' ' THR . 0.6 OUTLIER -146.31 -76.78 0.19 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.475 178.733 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -148.1 127.05 2.48 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 110.519 -1.033 . . . . 0.0 110.519 177.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -118.69 164.47 15.31 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.851 0.358 . . . . 0.0 111.296 -175.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 27.9 t -63.79 144.3 57.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.237 177.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.54 -8.16 58.47 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.297 -178.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -111.37 -33.69 6.34 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.08 -0.248 . . . . 0.0 111.148 -178.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.432 ' SG ' ' NZ ' ' A' ' 111' ' ' LYS . 32.0 m -100.03 -79.2 0.5 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.552 0.691 . . . . 0.0 110.272 175.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.608 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 113.28 57.56 0.41 Allowed Glycine 0 N--CA 1.442 -0.958 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.767 -176.267 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -146.65 178.39 8.33 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 177.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.29 160.48 29.59 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.383 0.611 . . . . 0.0 111.326 -177.524 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.771 HG22 HG12 ' A' ' 100' ' ' VAL . 2.8 mp -118.65 100.3 51.17 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.542 177.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.616 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 6.4 Cg_exo -75.41 167.78 25.93 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 123.238 2.626 . . . . 0.0 112.029 176.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.84 -16.01 60.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.88 -177.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.07 -17.24 29.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.955 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.616 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 12.6 mp0 -100.42 147.82 25.43 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.338 -177.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.401 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 21.9 mt -103.97 141.72 35.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.031 0.443 . . . . 0.0 111.088 -176.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.771 HG12 HG22 ' A' ' 94' ' ' ILE . 0.9 OUTLIER -125.94 147.24 30.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.037 178.121 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.454 ' SD ' ' HA ' ' A' ' 110' ' ' LEU . 0.0 OUTLIER -97.94 112.59 24.46 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.007 0.432 . . . . 0.0 110.308 -179.215 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -82.51 113.12 20.03 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.472 -179.092 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -100.11 -45.51 5.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.675 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.45 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 4.9 mm-40 -154.76 -137.84 0.07 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.102 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.45 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -75.47 -9.59 84.54 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 120.951 -0.643 . . . . 0.0 112.293 179.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -105.24 160.58 14.98 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 176.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -118.66 139.4 46.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.209 0.528 . . . . 0.0 111.921 -174.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -131.48 168.32 17.84 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 174.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.817 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 73.9 m80 -94.53 -163.92 1.11 Allowed 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.454 ' HA ' ' SD ' ' A' ' 101' ' ' MET . 0.4 OUTLIER -84.03 -20.22 33.09 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.002 0.429 . . . . 0.0 110.977 177.153 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.467 ' HZ1' ' CB ' ' A' ' 112' ' ' CYS . 0.0 OUTLIER -89.79 -22.09 22.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.74 -175.263 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.817 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -94.45 -5.46 46.18 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.156 -173.548 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.63 74.54 4.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.358 0.599 . . . . 0.0 109.616 175.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.602 HG22 ' HG2' ' A' ' 121' ' ' ARG . 38.2 p -127.39 147.8 50.27 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.171 -179.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.537 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 7.6 p -71.38 146.58 48.66 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.17 0.509 . . . . 0.0 110.355 177.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.08 -1.79 57.25 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.378 -176.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.35 -51.25 3.69 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -175.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.62 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -119.52 -3.71 10.39 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 111.645 0.239 . . . . 0.0 111.645 -175.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 70.61 38.98 1.2 Allowed 'General case' 0 C--O 1.233 0.221 0 O-C-N 123.847 0.717 . . . . 0.0 110.6 179.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -78.91 128.29 33.11 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.917 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.602 ' HG2' HG22 ' A' ' 114' ' ' THR . 0.2 OUTLIER -78.64 109.08 12.52 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 178.468 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.438 HD21 ' HB2' ' A' ' 128' ' ' PHE . 6.4 mt -67.73 148.59 51.08 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.914 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -136.8 140.28 31.37 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.214 -170.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . 0.702 ' HB3' ' HA ' ' A' ' 407' ' ' PHE . 13.5 Cg_endo -55.77 111.42 0.76 Allowed 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.943 2.428 . . . . 0.0 111.887 178.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 108.06 -15.47 36.65 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.311 -176.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -97.55 -179.24 4.4 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.791 ' HD3' ' HG3' ' A' ' 138' ' ' GLU . 0.1 OUTLIER -101.77 143.11 32.1 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.055 0.455 . . . . 0.0 111.462 -171.932 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.438 ' HB2' HD21 ' A' ' 122' ' ' LEU . 1.4 p90 -149.72 151.46 33.69 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.748 176.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . 0.601 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 59.9 m-70 -113.29 118.51 34.83 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.033 0.444 . . . . 0.0 110.88 -177.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.469 ' HA ' ' O ' ' A' ' 134' ' ' SER . 23.5 t80 -108.36 101.35 10.55 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.879 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.511 HG22 ' O ' ' A' ' 145' ' ' LEU . 2.6 mt -130.64 132.41 64.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.771 179.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 55.7 t30 55.38 35.76 25.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.407 0.622 . . . . 0.0 110.449 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.401 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 67.36 35.93 88.33 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.809 178.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.469 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 4.3 m -131.27 151.18 51.74 Favored 'General case' 0 CA--C 1.517 -0.318 0 O-C-N 122.677 -0.308 . . . . 0.0 110.294 -177.529 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.7 mt -101.94 121.32 41.91 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.714 -177.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.601 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 59.7 m-85 -126.51 172.27 10.36 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 175.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 8.9 p -125.24 177.49 6.1 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.727 0.298 . . . . 0.0 110.774 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.791 ' HG3' ' HD3' ' A' ' 127' ' ' ARG . 8.8 mm-40 -77.92 -13.52 59.86 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.013 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -78.14 -33.45 50.38 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.62 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 2.7 p30 -91.92 -48.08 6.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.279 176.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 141' ' ' ARG . 0.0 OUTLIER 43.64 88.23 0.1 Allowed Pre-proline 0 N--CA 1.466 0.331 0 C-N-CA 124.118 0.967 . . . . 0.0 112.993 175.313 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -72.25 72.8 2.77 Favored 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 122.971 2.447 . . . . 0.0 112.041 178.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.41 55.81 0.82 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.469 0.652 . . . . 0.0 111.789 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -147.87 -56.75 0.23 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 175.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.511 ' O ' HG22 ' A' ' 131' ' ' ILE . 0.2 OUTLIER -90.34 71.87 7.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.78 174.721 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.324 -0.5 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.346 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.555 0 N-CA-C 111.882 -0.487 . . . . 0.0 111.882 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.48 155.91 20.34 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . 0.414 ' HA ' HD11 ' A' ' 404' ' ' ILE . 47.7 mm -110.0 134.97 50.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.466 -178.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -68.98 121.81 82.93 Favored Pre-proline 0 C--N 1.328 -0.348 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 175.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -57.54 -90.99 0.0 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.125 2.55 . . . . 0.0 112.905 -175.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . 0.702 ' HA ' ' HB3' ' A' ' 124' ' ' PRO . 0.2 OUTLIER -171.78 150.9 2.68 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -178.833 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . 0.603 ' HD2' ' CD1' ' A' ' 407' ' ' PHE . 47.8 Cg_endo -72.7 111.25 3.2 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 121.761 1.64 . . . . 0.0 110.723 168.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -120.38 170.36 9.44 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.358 -173.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -92.1 109.96 21.32 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 176.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . 0.428 ' HB3' HG22 ' A' ' 100' ' ' VAL . . . -84.11 -94.09 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.216 -176.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -131.24 126.32 21.37 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.895 -177.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -62.99 125.03 15.04 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.613 2.209 . . . . 0.0 111.292 173.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 414' ' ' THR . . . . . 0.689 ' HB ' HD21 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -107.42 162.35 14.0 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.039 -176.06 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 415' ' ' SER . . . . . 0.521 ' HA ' ' HA3' ' A' ' 82' ' ' GLY . 14.1 m . . . . . 0 C--O 1.235 0.291 0 O-C-N 123.568 0.542 . . . . 0.0 110.686 -178.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.516 -0.344 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.493 HD23 ' HB1' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -96.16 112.98 24.55 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.213 -173.094 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -61.05 -38.75 87.28 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.705 0.764 . . . . 0.0 109.179 175.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.405 ' C ' ' H ' ' A' ' 84' ' ' SER . . . -100.83 111.79 4.24 Favored Glycine 0 N--CA 1.441 -0.974 0 N-CA-C 109.855 -1.298 . . . . 0.0 109.855 168.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -71.68 12.72 0.33 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -170.051 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.565 ' HB2' ' HB3' ' A' ' 412' ' ' LEU . 0.1 OUTLIER -82.0 -37.12 27.07 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.604 0.24 . . . . 0.0 110.869 178.269 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 176.67 170.11 38.82 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.927 -0.654 . . . . 0.0 111.859 -177.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.493 ' HB1' HD23 ' A' ' 80' ' ' LEU . . . -162.45 171.36 17.23 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.946 0.373 . . . . 0.0 110.814 -178.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.519 ' HB2' ' CE1' ' A' ' 109' ' ' HIS . 42.1 t -73.16 145.86 46.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.911 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.13 -6.96 59.49 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.997 0.427 . . . . 0.0 110.505 175.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -113.04 -49.89 2.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.067 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 26.9 m -84.4 -28.08 27.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.049 0.452 . . . . 0.0 110.604 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.97 25.9 75.01 Favored Glycine 0 N--CA 1.451 -0.341 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.947 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -115.38 142.08 47.17 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.491 -0.188 . . . . 0.0 110.491 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.7 m -65.55 157.74 28.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.143 176.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.656 ' O ' ' HA ' ' A' ' 413' ' ' PRO . 3.4 mp -113.12 116.69 46.74 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.477 -172.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.442 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 6.2 Cg_exo -75.52 165.95 29.52 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.925 2.417 . . . . 0.0 111.192 171.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.72 -16.65 61.66 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.34 0.59 . . . . 0.0 110.505 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.18 -14.77 59.32 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.093 177.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.442 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -109.64 159.57 17.01 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.184 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.3 mt -120.97 146.8 46.29 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.511 0.672 . . . . 0.0 110.931 -176.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.557 HG21 ' HB3' ' A' ' 411' ' ' ALA . 13.9 m -119.76 179.28 2.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.96 -178.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.1 mmt -134.09 122.38 22.84 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 174.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.4 105.38 12.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.049 0.452 . . . . 0.0 110.973 -175.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -88.25 66.75 8.55 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.866 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 55.7 47.36 20.69 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.368 178.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 130.74 -59.63 0.69 Allowed Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.407 178.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -89.99 170.31 10.47 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.886 -0.185 . . . . 0.0 110.553 -178.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -127.33 134.01 66.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.515 0.674 . . . . 0.0 112.42 -174.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -116.79 179.13 4.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 169.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.874 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 72.8 m80 -94.99 -164.29 1.15 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 176.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.6 tp -79.16 -23.03 44.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.949 0.404 . . . . 0.0 110.9 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.445 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.35 -38.29 13.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.253 0.549 . . . . 0.0 111.35 -176.759 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.874 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.26 -17.66 59.37 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.388 -175.472 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -72.16 77.02 0.96 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.592 0.711 . . . . 0.0 110.327 176.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.78 HG23 ' HA ' ' A' ' 121' ' ' ARG . 0.9 OUTLIER -145.6 164.05 32.9 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.083 -177.224 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.496 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 19.9 p -77.97 152.56 33.08 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 120.25 -0.58 . . . . 0.0 109.858 176.036 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.9 5.61 50.72 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.236 0.541 . . . . 0.0 110.722 -179.127 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.1 -50.77 3.55 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.804 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.93 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -113.53 -13.06 12.82 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.701 0.286 . . . . 0.0 111.064 178.183 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.496 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 65.45 39.36 5.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.38 -177.602 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -86.44 133.16 33.79 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 176.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.78 ' HA ' HG23 ' A' ' 114' ' ' THR . 0.0 OUTLIER -70.32 109.77 4.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.33 -179.01 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.592 HD13 ' HB2' ' A' ' 128' ' ' PHE . 19.8 mt -63.9 149.95 46.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.415 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.542 ' HB ' ' CB ' ' A' ' 126' ' ' ASP . 21.6 t -110.23 130.75 22.52 Favored Pre-proline 0 C--N 1.321 -0.636 0 C-N-CA 120.314 -0.554 . . . . 0.0 110.962 -167.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . 0.455 ' HB3' ' HA ' ' A' ' 407' ' ' PHE . 17.9 Cg_endo -58.93 111.5 0.91 Allowed 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.843 2.362 . . . . 0.0 111.046 174.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 92.6 13.75 56.44 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.23 -177.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.542 ' CB ' ' HB ' ' A' ' 123' ' ' VAL . 1.4 t70 -133.09 -172.93 3.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.599 0.238 . . . . 0.0 110.755 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.21 136.55 57.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.059 -0.518 . . . . 0.0 112.31 -174.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.592 ' HB2' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -157.13 144.97 19.1 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.359 -0.837 . . . . 0.0 108.852 172.85 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . 0.528 ' O ' ' HA ' ' A' ' 135' ' ' LEU . 66.0 m-70 -118.6 125.99 50.98 Favored 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.752 -178.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.463 ' HB2' ' CE2' ' A' ' 128' ' ' PHE . 83.7 t80 -125.4 101.3 6.88 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -128.84 120.45 52.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.343 -177.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.5 t30 59.92 32.75 21.34 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.135 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 74.63 33.29 56.14 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.671 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -133.99 131.76 39.32 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.528 ' HA ' ' O ' ' A' ' 129' ' ' HIS . 6.1 mp -98.93 133.98 42.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.501 -176.424 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.451 ' HA ' ' CB ' ' A' ' 115' ' ' CYS . 21.0 m-85 -136.85 166.03 24.58 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.544 178.012 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 16.4 p -109.27 -168.45 1.34 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.913 0.387 . . . . 0.0 110.839 178.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -77.64 -26.71 50.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.472 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -73.55 -42.31 61.85 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.563 -175.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.93 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 0.6 OUTLIER -101.19 -2.17 32.0 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.469 -176.59 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 32.0 ttt-85 -29.69 105.61 0.22 Allowed Pre-proline 0 N--CA 1.478 0.931 0 O-C-N 124.517 1.136 . . . . 0.0 113.336 -178.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -79.06 88.78 1.42 Allowed 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 123.242 2.628 . . . . 0.0 112.301 178.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.52 -30.67 61.12 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.485 -0.779 . . . . 0.0 112.708 -176.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -75.08 -15.77 60.6 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -175.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 145' ' ' LEU . 1.0 OUTLIER -91.87 -22.39 20.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.818 0.342 . . . . 0.0 111.222 -175.95 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.491 ' H ' HG13 ' A' ' 146' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.561 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.562 -177.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.629 0 N-CA-C 111.066 -0.814 . . . . 0.0 111.066 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -116.2 169.52 9.22 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 173.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . 0.419 ' HA ' HD11 ' A' ' 404' ' ' ILE . 50.9 mm -114.44 126.13 71.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . 0.506 ' HB3' ' O ' ' A' ' 123' ' ' VAL . . . -66.87 134.87 94.09 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.909 -177.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 20.0 Cg_exo -67.01 -176.19 0.73 Allowed 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 123.082 2.521 . . . . 0.0 111.715 176.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . 0.455 ' HA ' ' HB3' ' A' ' 124' ' ' PRO . 27.6 m-85 -107.94 163.46 16.91 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.942 -179.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -54.35 116.78 3.3 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.551 2.167 . . . . 0.0 111.704 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.7 177.53 4.64 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.123 -176.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -116.6 121.81 42.79 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 174.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . 0.557 ' HB3' HG21 ' A' ' 100' ' ' VAL . . . -90.88 -141.35 0.17 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.875 0.369 . . . . 0.0 111.244 -176.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.565 ' HB3' ' HB2' ' A' ' 84' ' ' SER . 0.0 OUTLIER -90.96 113.25 57.49 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.136 -179.41 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . 0.656 ' HA ' ' O ' ' A' ' 94' ' ' ILE . 14.6 Cg_endo -57.77 151.04 58.59 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.997 2.465 . . . . 0.0 113.173 -178.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 3.2 m -71.17 129.82 39.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.265 -178.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.451 -0.386 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 174.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.395 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.672 HD13 ' HA ' ' A' ' 83' ' ' ASN . 1.3 pt? -96.2 28.98 2.98 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.195 176.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.619 ' HB3' HG23 ' A' ' 414' ' ' THR . 0.3 OUTLIER 52.64 74.69 0.27 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.99 -179.76 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 92.56 -125.63 8.21 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.222 -173.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.672 ' HA ' HD13 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -162.02 66.78 0.25 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.234 0.54 . . . . 0.0 110.4 178.914 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.38 -72.47 0.7 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.046 178.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -141.7 142.87 12.34 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 121.186 -0.531 . . . . 0.0 111.916 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -137.67 158.86 43.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.969 0.414 . . . . 0.0 110.91 -178.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.493 ' HB2' ' CE1' ' A' ' 109' ' ' HIS . 38.0 t -85.89 144.92 27.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.349 177.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.32 -4.0 58.6 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.882 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -117.11 -47.59 2.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.488 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 57.0 m -82.6 -40.64 20.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.852 0.358 . . . . 0.0 111.276 -179.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 85.57 9.16 79.23 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 110.814 -0.915 . . . . 0.0 110.814 -172.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.471 ' NE2' ' H ' ' A' ' 93' ' ' SER . 0.0 OUTLIER -93.88 164.7 13.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.366 -0.417 . . . . 0.0 109.953 179.213 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.608 ' HG ' ' HB2' ' A' ' 81' ' ' PHE . 0.0 OUTLIER -82.03 171.28 14.57 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.059 0.457 . . . . 0.0 111.218 -179.831 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.683 HG22 HG12 ' A' ' 100' ' ' VAL . 2.6 mp -114.77 105.31 53.48 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.372 175.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -73.8 159.12 45.87 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.767 2.311 . . . . 0.0 112.076 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.91 -13.08 61.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.975 0.416 . . . . 0.0 111.118 -178.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.74 12.26 32.62 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.926 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -123.2 157.04 33.91 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.221 0.534 . . . . 0.0 110.718 -179.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.6 mt -114.68 130.03 56.76 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.314 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.683 HG12 HG22 ' A' ' 94' ' ' ILE . 13.2 m -129.66 168.06 23.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.773 -175.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -112.11 141.13 46.18 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.022 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.2 136.35 49.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.361 -178.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -150.97 121.83 7.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.684 -0.234 . . . . 0.0 110.998 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 70.2 -2.64 2.04 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.162 0.585 . . . . 0.0 111.733 176.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 115.83 -16.09 16.29 Favored Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -175.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -89.97 163.92 14.76 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -124.4 140.21 48.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.034 0.445 . . . . 0.0 111.669 -177.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . 0.545 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 98.2 m-85 -131.09 167.49 19.01 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.366 -0.833 . . . . 0.0 108.771 175.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.8 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 72.5 m80 -92.73 -159.14 0.65 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 176.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 5.0 mt -85.29 -22.0 28.75 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.994 0.426 . . . . 0.0 111.37 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.63 -35.61 14.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.939 0.4 . . . . 0.0 111.763 -176.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.8 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.5 -16.66 59.59 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.207 -175.678 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.66 64.53 6.41 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.397 177.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.833 HG21 ' HA ' ' A' ' 121' ' ' ARG . 0.6 OUTLIER -131.14 152.47 50.4 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.774 -179.67 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 5.0 t -64.23 132.21 49.63 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 175.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 3.4 m -82.27 2.47 31.83 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.548 -176.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -106.03 -49.38 3.39 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -176.157 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.532 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 28.2 p -112.04 -14.42 13.45 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.055 0.455 . . . . 0.0 110.654 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.469 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 73.8 23.81 2.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.287 -179.034 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . 0.532 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 3.2 m-80 -65.88 133.63 51.33 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 170.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.833 ' HA ' HG21 ' A' ' 114' ' ' THR . 10.7 tpp85 -75.29 119.55 19.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.243 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.5 HD21 ' HB2' ' A' ' 128' ' ' PHE . 23.6 mt -58.89 137.19 57.93 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.428 ' H ' HG21 ' A' ' 123' ' ' VAL . 0.1 OUTLIER -115.27 132.38 23.09 Favored Pre-proline 0 C--N 1.321 -0.641 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.309 -165.972 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . 0.452 ' HB2' ' CE2' ' A' ' 407' ' ' PHE . 19.9 Cg_endo -60.63 111.7 1.12 Allowed 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.628 2.219 . . . . 0.0 110.992 175.314 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 110.29 -4.48 29.89 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.604 -0.807 . . . . 0.0 112.045 -178.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.412 ' O ' ' HA ' ' A' ' 404' ' ' ILE . 1.0 OUTLIER -124.45 -177.76 3.9 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 177.203 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.508 ' HD2' ' HG3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -90.5 149.71 22.09 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.385 0.612 . . . . 0.0 112.348 -172.176 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.5 ' HB2' HD21 ' A' ' 122' ' ' LEU . 5.8 p90 -144.91 147.19 32.47 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.946 -1.025 . . . . 0.0 108.577 172.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -112.73 113.75 26.0 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.12 0.486 . . . . 0.0 110.973 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.483 ' CE2' ' HA2' ' A' ' 133' ' ' GLY . 3.8 t80 -92.66 101.1 13.5 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 175.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 28.1 mm -112.56 115.06 48.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.937 -176.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.5 t30 54.41 35.72 23.79 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 123.657 0.598 . . . . 0.0 111.288 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.483 ' HA2' ' CE2' ' A' ' 130' ' ' TYR . . . 80.24 30.11 42.88 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.938 177.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.409 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 0.7 OUTLIER -133.92 146.64 50.7 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.733 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.1 mt -95.37 118.98 33.08 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.865 0.364 . . . . 0.0 110.848 -177.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.409 ' CE2' ' HB2' ' A' ' 134' ' ' SER . 69.0 m-85 -126.85 159.66 33.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.939 176.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . 0.535 ' SG ' ' HB2' ' A' ' 140' ' ' ASP . 14.4 p -101.02 169.91 8.63 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.442 -178.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.508 ' HG3' ' HD2' ' A' ' 127' ' ' ARG . 1.5 mm-40 -77.9 -17.7 56.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.267 0.556 . . . . 0.0 110.264 174.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -20.76 58.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.622 0.725 . . . . 0.0 109.222 179.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.535 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 0.4 OUTLIER -104.07 -67.86 0.88 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.995 178.567 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 52.51 89.66 0.1 OUTLIER Pre-proline 0 N--CA 1.466 0.355 0 C-N-CA 123.468 0.707 . . . . 0.0 112.376 178.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -58.19 99.42 0.1 OUTLIER 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.047 2.498 . . . . 0.0 112.405 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.83 -26.64 63.37 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.96 -176.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.69 -39.84 95.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.774 -177.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.2 mt -152.28 90.87 1.54 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.501 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.41 ' H ' HG13 ' A' ' 146' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.956 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.952 0 N-CA-C 112.73 -0.148 . . . . 0.0 112.73 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -76.01 118.05 18.36 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 173.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . 0.412 ' HA ' ' O ' ' A' ' 126' ' ' ASP . 30.2 mm -81.54 138.95 18.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.938 -174.338 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -57.9 128.72 81.22 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.391 176.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . 0.6 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 38.1 Cg_endo -66.98 -5.46 13.56 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.383 2.722 . . . . 0.0 113.93 -174.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . 0.6 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 21.0 m-85 78.06 156.59 0.14 Allowed Pre-proline 0 N--CA 1.468 0.434 0 O-C-N 124.011 0.819 . . . . 0.0 109.935 -178.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.95 128.56 10.06 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.42 2.08 . . . . 0.0 112.203 176.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -140.44 177.21 8.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.585 176.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -86.29 125.63 33.74 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.784 0.326 . . . . 0.0 110.871 -179.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -91.92 -143.03 0.19 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.165 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 13.3 mt -85.35 116.55 66.01 Favored Pre-proline 0 N--CA 1.452 -0.369 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 177.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.75 154.82 67.18 Favored 'Trans proline' 0 C--O 1.237 0.453 0 C-N-CA 122.818 2.346 . . . . 0.0 112.84 -178.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 414' ' ' THR . . . . . 0.619 HG23 ' HB3' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -69.25 154.61 41.76 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.259 179.775 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.174 179.569 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.409 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.3 OUTLIER . . . . . 0 C--O 1.233 0.202 0 CA-C-O 121.534 0.683 . . . . 0.0 110.015 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.776 HD13 ' HA ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -121.56 113.71 20.17 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.607 -172.627 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -61.2 -35.56 77.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.32 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -124.3 26.43 5.79 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.149 -0.548 . . . . 0.0 111.963 179.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.776 ' HA ' HD13 ' A' ' 80' ' ' LEU . 2.7 t-20 69.41 161.73 0.21 Allowed 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.509 0.724 . . . . 0.0 112.801 178.143 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 51.4 m 71.76 -61.15 0.5 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.008 -0.996 . . . . 0.0 113.46 174.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -89.23 122.2 6.36 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.547 -0.835 . . . . 0.0 113.22 -174.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.5 ' HA ' ' HA ' ' A' ' 93' ' ' SER . . . -168.29 133.42 1.76 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.578 0.228 . . . . 0.0 111.127 177.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.33 133.57 34.04 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 171.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.7 m -86.66 8.66 21.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.052 -0.522 . . . . 0.0 112.229 -172.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.653 ' HB2' ' HB3' ' A' ' 112' ' ' CYS . . . -98.17 -59.53 1.74 Allowed 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.082 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 26.1 p -86.42 -60.08 2.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.254 0.549 . . . . 0.0 110.609 -177.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.409 ' HA2' ' HE ' ' A' ' 79' ' ' ARG . . . 133.07 -2.8 4.79 Favored Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.739 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -82.19 122.24 27.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.902 0.382 . . . . 0.0 110.279 178.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 86' ' ' ALA . 0.9 OUTLIER -63.13 128.03 33.96 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.809 172.833 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.422 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 1.7 mt -65.31 119.66 61.17 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.789 -174.266 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 94' ' ' ILE . 2.9 Cg_exo -76.88 166.9 26.17 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.25 2.633 . . . . 0.0 111.817 176.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.42 0.85 18.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.931 0.396 . . . . 0.0 111.499 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.18 21.39 14.22 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.875 179.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -135.88 160.31 38.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.739 179.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.1 mp -120.86 150.55 40.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.336 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.9 157.4 42.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.939 -178.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.0 126.78 52.6 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.078 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 10.1 mtt-85 -91.48 97.77 11.27 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.68 -59.07 4.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.752 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.3 91.12 0.37 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.004 179.163 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 82.09 -52.69 4.66 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.012 -0.613 . . . . 0.0 112.292 -176.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -90.97 158.66 16.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.586 0.231 . . . . 0.0 111.285 -178.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -118.09 144.24 26.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.9 0.381 . . . . 0.0 111.072 -177.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -137.0 163.74 30.01 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.672 177.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.772 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 12.4 m80 -79.49 170.82 16.01 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.824 0.345 . . . . 0.0 110.773 -179.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.38 -31.61 72.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.821 177.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.507 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.48 -30.83 18.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.122 0.487 . . . . 0.0 110.551 178.609 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.772 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 34.0 m -79.0 -13.74 59.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.148 -178.131 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -76.18 76.03 3.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.091 174.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.766 HG21 ' HA ' ' A' ' 121' ' ' ARG . 0.7 OUTLIER -133.79 149.7 51.42 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.115 -178.425 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.449 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 5.5 p -74.53 155.16 38.22 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.142 0.496 . . . . 0.0 111.174 -179.376 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 1.5 m -79.68 -45.68 18.53 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.248 -175.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.74 -51.57 39.93 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -171.222 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.79 -14.65 16.53 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 121.051 -0.259 . . . . 0.0 111.196 -175.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.449 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 69.41 31.65 3.74 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.88 -176.819 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -83.4 146.96 28.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.639 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.766 ' HA ' HG21 ' A' ' 114' ' ' THR . 9.0 ttt180 -85.84 135.47 33.7 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.879 0.371 . . . . 0.0 111.313 -175.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.0 mt -81.75 125.71 30.96 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 38.6 t -122.56 138.38 29.21 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.621 -170.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.43 111.41 0.93 Allowed 'Trans proline' 0 N--CA 1.463 -0.277 0 C-N-CA 122.406 2.07 . . . . 0.0 111.072 174.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 114.34 -21.36 15.06 Favored Glycine 0 N--CA 1.446 -0.641 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 -173.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.47 176.02 5.49 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.711 ' HB2' ' HB2' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -102.46 135.83 43.38 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.703 0.287 . . . . 0.0 111.363 -173.807 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -132.52 159.6 38.95 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.027 179.322 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 78.1 m-70 -130.09 140.58 50.8 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.774 0.321 . . . . 0.0 110.528 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.439 ' HD1' HD21 ' A' ' 135' ' ' LEU . 10.7 t80 -125.28 101.98 7.23 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 178.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.425 HD11 ' HB ' ' A' ' 146' ' ' ILE . 7.6 mt -121.84 111.33 30.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 120.732 0.301 . . . . 0.0 110.649 -176.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 51.7 t30 57.87 51.13 9.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.667 179.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.418 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 62.19 35.58 91.74 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.736 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 2.6 m -133.38 138.85 46.48 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -177.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.439 HD21 ' HD1' ' A' ' 130' ' ' TYR . 24.3 mt -92.67 125.34 37.25 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.975 -175.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.512 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 76.5 m-85 -129.43 161.96 29.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.055 176.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . 0.46 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 17.1 p -111.07 -176.14 2.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.953 0.406 . . . . 0.0 111.298 -175.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.711 ' HB2' ' HB2' ' A' ' 127' ' ' ARG . 0.0 OUTLIER -71.56 -32.94 68.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.871 176.661 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -68.11 -34.42 76.34 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 177.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.46 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.7 OUTLIER -66.35 -77.73 0.06 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.271 175.47 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 44.18 70.59 1.83 Allowed Pre-proline 0 CA--C 1.529 0.15 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.855 -176.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -72.09 78.66 1.81 Allowed 'Trans proline' 0 C--O 1.236 0.394 0 C-N-CA 122.762 2.308 . . . . 0.0 111.786 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 18.4 m -57.79 -41.2 81.63 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.993 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -71.62 -24.28 61.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.945 0.402 . . . . 0.0 111.45 -177.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -79.79 -52.66 7.64 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.1 -178.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.425 ' HB ' HD11 ' A' ' 131' ' ' ILE . 0.8 OUTLIER . . . . . 0 C--N 1.325 -0.494 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.728 -175.526 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.615 0 N-CA-C 111.98 -0.448 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.48 144.91 28.42 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.866 0.365 . . . . 0.0 110.811 -178.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 28.4 mm -79.43 141.74 14.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 177.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . 0.454 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -50.25 127.06 22.24 Favored Pre-proline 0 N--CA 1.462 0.128 0 O-C-N 123.289 0.368 . . . . 0.0 111.025 177.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 15.3 Cg_exo -69.45 10.29 0.46 Allowed 'Trans proline' 0 N--CA 1.475 0.44 0 C-N-CA 123.733 2.956 . . . . 0.0 114.023 -171.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . 0.4 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 15.1 m-85 70.34 158.54 0.16 Allowed Pre-proline 0 N--CA 1.466 0.355 0 O-C-N 123.554 0.534 . . . . 0.0 111.741 176.023 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -83.89 149.38 12.4 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.647 2.232 . . . . 0.0 112.915 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -155.13 160.74 41.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.441 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -78.19 124.59 28.25 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 176.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -94.45 -139.48 0.23 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.288 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.45 111.79 50.86 Favored Pre-proline 0 C--N 1.329 -0.286 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 175.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_exo -61.75 132.18 38.88 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.512 2.141 . . . . 0.0 112.16 -179.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.64 139.03 51.22 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.407 -179.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.469 0.517 0 C-N-CA 123.777 0.831 . . . . 0.0 111.845 177.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.0 ttt85 . . . . . 0 CA--C 1.521 -0.148 0 CA-C-O 121.31 0.576 . . . . 0.0 109.793 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.675 HD23 ' HB1' ' A' ' 86' ' ' ALA . 0.4 OUTLIER -154.76 -176.72 6.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.116 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -82.26 72.04 9.32 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.54 0.686 . . . . 0.0 110.067 176.52 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 125.29 -117.65 3.03 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.413 -178.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -159.32 175.49 13.31 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 178.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 10.5 m 62.09 73.29 0.47 Allowed 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.88 0.737 . . . . 0.0 112.04 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . 0.668 ' HA3' HG21 ' A' ' 414' ' ' THR . . . 128.59 83.41 0.37 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.191 -1.004 . . . . 0.0 112.978 175.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.675 ' HB1' HD23 ' A' ' 80' ' ' LEU . . . -148.25 144.37 27.61 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.629 -0.336 . . . . 0.0 110.181 178.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 4.7 t -66.65 142.62 57.39 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.693 177.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.584 ' HB2' ' CE1' ' A' ' 108' ' ' TYR . 0.7 OUTLIER -95.13 8.37 43.21 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.677 174.637 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.671 ' HB1' ' HB3' ' A' ' 112' ' ' CYS . . . -118.42 -59.7 1.86 Allowed 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.622 -179.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.431 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 31.1 p -91.09 -73.97 0.52 Allowed 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.167 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.431 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 129.56 61.02 0.1 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.548 176.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.499 ' NE2' ' HA ' ' A' ' 92' ' ' GLN . 0.5 OUTLIER -137.52 150.51 47.58 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.6 0.238 . . . . 0.0 110.374 178.612 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.0 119.71 14.62 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.972 176.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.5 mp -76.54 120.23 80.79 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.785 -174.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 98' ' ' GLU . 5.7 Cg_exo -77.74 166.24 25.69 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.524 2.816 . . . . 0.0 111.778 173.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.23 -21.05 61.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.962 0.411 . . . . 0.0 110.982 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.42 -13.66 58.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.282 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.408 ' HB3' ' HD2' ' A' ' 95' ' ' PRO . 15.1 tt0 -106.38 121.08 43.53 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.038 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 21.2 mt -84.75 139.3 32.07 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.552 -178.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.42 ' O ' ' HA ' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -115.09 144.59 22.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.945 -178.229 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.57 ' HE1' ' HD3' ' A' ' 124' ' ' PRO . 0.0 OUTLIER -91.81 120.26 32.36 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.993 179.965 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -96.74 108.76 21.46 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.034 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -82.34 -40.22 21.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.055 0.455 . . . . 0.0 110.152 175.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.415 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -174.34 -106.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.582 176.747 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.415 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -76.69 -30.19 56.57 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.603 -0.808 . . . . 0.0 111.719 176.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -89.38 159.48 17.3 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.714 0.292 . . . . 0.0 110.974 -176.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -128.99 135.91 60.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.834 -179.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . 0.584 ' CE1' ' HB2' ' A' ' 88' ' ' SER . 74.3 m-85 -135.92 164.79 27.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.445 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.836 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 19.4 m80 -92.32 172.33 8.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.537 179.169 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.43 ' HG ' ' SD ' ' A' ' 101' ' ' MET . 0.5 OUTLIER -65.15 -30.96 71.92 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.341 0.591 . . . . 0.0 110.665 175.232 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.423 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 2.4 pttt -90.11 -13.51 35.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.85 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.836 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 35.4 m -103.77 -20.76 13.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.126 -173.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . 0.519 ' HD1' ' HA ' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -64.85 98.27 0.27 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.269 177.669 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.768 HG21 ' HA ' ' A' ' 121' ' ' ARG . 2.8 p -147.7 160.88 42.21 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -178.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 9.1 p -83.89 153.18 24.13 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 120.815 0.341 . . . . 0.0 110.296 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.16 -16.12 59.25 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.308 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.76 -51.05 5.71 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -173.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.79 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -112.85 -15.63 12.87 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.771 -0.371 . . . . 0.0 111.322 -178.024 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 67.69 36.31 3.68 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 123.624 0.577 . . . . 0.0 110.161 -176.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -73.81 123.51 24.32 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 175.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.768 ' HA ' HG21 ' A' ' 114' ' ' THR . 1.4 mtm180 -74.78 106.46 6.33 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.884 0.374 . . . . 0.0 110.744 -175.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.629 HD21 ' HB2' ' A' ' 128' ' ' PHE . 2.7 mt -66.1 133.94 51.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.007 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.489 HG13 ' HD2' ' A' ' 124' ' ' PRO . 14.8 t -132.85 142.28 44.13 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.695 -171.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . 0.57 ' HD3' ' HE1' ' A' ' 101' ' ' MET . 41.0 Cg_exo -57.09 109.56 0.47 Allowed 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 121.86 1.706 . . . . 0.0 110.72 173.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 117.39 -13.56 13.63 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.561 -174.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -108.29 169.04 8.88 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 175.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.486 ' HB2' ' HB3' ' A' ' 138' ' ' GLU . 8.6 mtt85 -100.49 145.61 28.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.958 0.409 . . . . 0.0 111.374 -174.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.629 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.4 OUTLIER -148.34 171.94 15.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.883 -179.799 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . 0.549 ' CD2' ' HG3' ' A' ' 141' ' ' ARG . 3.3 m-70 -140.92 139.62 34.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.042 0.449 . . . . 0.0 111.282 178.262 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.62 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 46.6 t80 -124.26 103.24 8.12 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 13.5 mt -115.56 105.35 18.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.258 -175.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 64.4 24.56 13.23 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.033 174.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.62 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 92.94 31.86 8.31 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.614 -179.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.14 138.93 45.55 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 21.9 mt -96.94 127.74 43.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.957 0.408 . . . . 0.0 111.643 -176.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -135.0 160.9 36.84 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 173.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . 0.597 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 23.7 p -101.79 -171.76 2.03 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.193 0.521 . . . . 0.0 110.461 179.48 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.486 ' HB3' ' HB2' ' A' ' 127' ' ' ARG . 3.6 pt-20 -77.31 -21.44 53.49 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.176 177.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . 0.597 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 72.7 t60 -82.15 -40.84 21.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.485 -175.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.79 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 0.1 OUTLIER -103.24 9.84 37.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.224 -178.005 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . 0.549 ' HG3' ' CD2' ' A' ' 129' ' ' HIS . 15.1 ttp180 -43.9 110.84 1.03 Allowed Pre-proline 0 N--CA 1.468 0.456 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.217 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 6.3 Cg_exo -78.88 107.07 2.19 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 123.279 2.652 . . . . 0.0 112.2 -178.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 16.0 m -79.29 -20.41 48.09 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.166 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.92 -57.45 8.74 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 121.016 0.436 . . . . 0.0 110.462 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 1.7 mp -116.11 81.69 1.65 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.77 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 1.4 tt . . . . . 0 C--N 1.322 -0.607 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.299 -174.653 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.554 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.88 134.86 56.87 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.049 0.452 . . . . 0.0 112.116 -173.349 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 43.4 mm -66.94 136.56 26.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.623 174.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -52.98 124.95 38.92 Favored Pre-proline 0 C--N 1.331 -0.226 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 176.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . 0.452 ' O ' ' HD1' ' A' ' 407' ' ' PHE . 78.7 Cg_exo -46.31 -82.67 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.576 2.85 . . . . 0.0 113.136 -172.606 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . 0.616 ' CD2' ' HD2' ' A' ' 408' ' ' PRO . 0.2 OUTLIER 169.8 150.64 0.14 Allowed Pre-proline 0 C--N 1.329 -0.293 0 C-N-CA 123.437 0.695 . . . . 0.0 109.181 177.054 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . 0.616 ' HD2' ' CD2' ' A' ' 407' ' ' PHE . 87.0 Cg_endo -85.69 129.7 3.61 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.443 2.096 . . . . 0.0 112.606 174.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -139.53 164.04 30.95 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 177.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -74.71 110.87 9.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.679 0.276 . . . . 0.0 110.441 179.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . 0.408 ' HB2' ' H ' ' A' ' 412' ' ' LEU . . . -84.2 -90.78 0.09 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.941 -176.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.408 ' H ' ' HB2' ' A' ' 411' ' ' ALA . 0.6 OUTLIER -131.4 130.79 22.63 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.564 -176.004 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.18 131.64 35.39 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.843 2.362 . . . . 0.0 111.328 173.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 414' ' ' THR . . . . . 0.668 HG21 ' HA3' ' A' ' 85' ' ' GLY . 68.1 p -110.01 169.22 8.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.871 -172.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.533 0.322 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.867 177.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 . . . . . 0 N--CA 1.452 -0.337 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.618 HD23 ' N ' ' A' ' 80' ' ' LEU . 1.2 pt? -147.82 123.11 10.26 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.911 -1.04 . . . . 0.0 108.934 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -51.83 -60.02 3.65 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 123.622 0.576 . . . . 0.0 110.433 -175.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.72 124.44 8.02 Favored Glycine 0 N--CA 1.44 -1.068 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 168.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.418 ' HA ' HD13 ' A' ' 80' ' ' LEU . 39.1 t30 -65.01 87.51 0.06 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 117.069 0.434 . . . . 0.0 110.119 -179.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.611 ' H ' HD11 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -148.76 -58.68 0.22 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.402 -178.727 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . 0.469 ' O ' HG22 ' A' ' 414' ' ' THR . . . -150.57 163.29 29.57 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 121.035 -0.602 . . . . 0.0 111.858 179.149 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -167.11 162.19 15.15 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 -178.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.95 143.92 26.09 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.99 14.44 6.16 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -172.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.612 ' HB1' ' HB3' ' A' ' 112' ' ' CYS . . . -112.01 -58.23 2.16 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 121.055 -0.258 . . . . 0.0 111.28 179.504 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.529 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 32.0 p -95.32 -72.85 0.61 Allowed 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.47 -175.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.529 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 130.65 6.78 3.62 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 111.751 -0.54 . . . . 0.0 111.751 -176.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -83.99 117.81 23.63 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 174.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.59 124.28 20.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.703 -177.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.404 HG23 ' HB3' ' A' ' 98' ' ' GLU . 2.4 mt -64.85 111.33 5.57 Favored Pre-proline 0 C--N 1.329 -0.312 0 O-C-N 123.685 0.616 . . . . 0.0 112.119 -171.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.554 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 8.0 Cg_exo -73.63 168.15 25.49 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 123.064 2.509 . . . . 0.0 111.111 173.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.87 -0.49 11.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.868 0.366 . . . . 0.0 111.346 -178.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -116.59 13.25 15.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.009 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.554 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.6 OUTLIER -115.62 142.86 46.17 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.458 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.3 mp -109.64 138.74 45.56 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.291 -177.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.451 HG21 ' HB1' ' A' ' 411' ' ' ALA . 0.1 OUTLIER -120.21 146.96 24.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.558 -178.166 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.495 ' SD ' ' HG3' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -94.98 113.01 24.67 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.864 179.434 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.446 ' H ' ' HG3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -91.25 102.68 15.39 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.721 -177.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -78.93 -35.26 43.61 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.299 0.571 . . . . 0.0 110.163 176.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.437 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 30.3 mt-30 -148.98 -128.72 0.05 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.323 -178.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.437 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -91.19 10.07 75.91 Favored Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 110.988 -0.845 . . . . 0.0 110.988 172.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -120.14 143.81 48.0 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.188 -0.506 . . . . 0.0 109.837 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.414 ' H ' HG23 ' A' ' 107' ' ' VAL . 0.9 OUTLIER -113.72 140.8 32.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.296 0.57 . . . . 0.0 112.411 -173.503 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -131.37 160.69 34.31 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 172.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.844 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 21.7 m80 -83.05 170.39 14.9 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.823 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.454 ' HA ' ' SD ' ' A' ' 101' ' ' MET . 1.7 tp -66.96 -29.35 69.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.289 0.566 . . . . 0.0 109.9 174.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -89.24 -11.18 44.35 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.441 177.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.844 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 34.4 m -108.34 0.17 21.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.049 -176.197 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . 0.461 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.0 OUTLIER -86.04 59.99 5.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.373 0.606 . . . . 0.0 110.3 178.064 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.463 HG21 ' HA ' ' A' ' 121' ' ' ARG . 1.9 p -114.22 155.5 26.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.204 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.496 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 17.1 p -68.99 153.62 43.49 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.174 0.512 . . . . 0.0 110.487 177.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.79 7.44 30.44 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.483 -176.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.48 -51.09 2.82 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -176.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -115.31 -4.52 12.38 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.508 -177.064 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 66.13 32.04 8.4 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.105 -177.062 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . 0.415 ' HB3' ' HB3' ' A' ' 137' ' ' CYS . 58.2 t30 -79.45 124.17 28.22 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.347 177.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.463 ' HA ' HG21 ' A' ' 114' ' ' THR . 1.5 ttp180 -78.87 121.82 25.32 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.725 0.298 . . . . 0.0 110.633 -178.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.485 HD23 ' HB2' ' A' ' 128' ' ' PHE . 1.9 mt -69.61 162.0 28.5 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.202 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 75.8 t -128.64 130.34 23.5 Favored Pre-proline 0 C--N 1.328 -0.331 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.685 -174.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . 0.409 ' HG3' ' HE2' ' A' ' 101' ' ' MET . 36.3 Cg_exo -61.69 111.28 1.14 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.578 2.185 . . . . 0.0 110.81 174.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.11 -18.66 14.03 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.525 -176.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.474 ' O ' ' HA ' ' A' ' 404' ' ' ILE . 2.0 t70 -112.78 -168.91 1.38 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 177.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' A' ' 208' ' ' SER . 0.0 OUTLIER -90.76 147.14 23.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.473 0.654 . . . . 0.0 112.246 -171.441 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.485 ' HB2' HD23 ' A' ' 122' ' ' LEU . 0.4 OUTLIER -145.33 159.77 42.54 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.711 -1.132 . . . . 0.0 108.566 175.274 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . 0.467 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 11.2 m-70 -126.62 122.48 35.14 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.104 0.478 . . . . 0.0 111.299 -178.261 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.43 ' CE2' ' HA2' ' A' ' 133' ' ' GLY . 11.0 t80 -124.97 101.27 6.97 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 173.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 12.3 mt -124.54 124.18 67.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.464 -176.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 60.9 29.47 19.03 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.864 178.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.43 ' HA2' ' CE2' ' A' ' 130' ' ' TYR . . . 75.18 35.27 49.41 Favored Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.563 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.407 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 15.6 m -137.0 146.29 45.15 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.9 mt -98.79 130.4 45.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.346 0.593 . . . . 0.0 111.698 -174.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.496 ' HA ' ' HB2' ' A' ' 115' ' ' CYS . 40.3 m-85 -130.77 163.44 27.31 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.543 172.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . 0.616 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 31.0 p -106.54 -173.36 2.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.087 0.47 . . . . 0.0 111.366 -175.509 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.94 -26.43 59.6 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.492 177.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -77.96 -36.43 49.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.591 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.616 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.2 OUTLIER -57.66 -68.32 0.25 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.876 -1.057 . . . . 0.0 111.142 178.035 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 43.16 71.39 1.45 Allowed Pre-proline 0 N--CA 1.465 0.313 0 O-C-N 123.979 0.799 . . . . 0.0 111.389 -177.432 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -49.96 121.73 7.94 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.769 2.313 . . . . 0.0 112.244 -177.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.88 4.12 51.8 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.655 -176.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -104.2 -63.51 1.2 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.795 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -111.76 113.72 26.26 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.819 0.342 . . . . 0.0 110.236 178.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.323 -0.56 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.065 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.54 0 N-CA-C 112.08 -0.408 . . . . 0.0 112.08 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 208' ' ' SER . . . . . 0.439 ' O ' ' HA ' ' A' ' 127' ' ' ARG . 0.1 OUTLIER -78.7 165.21 23.88 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 177.422 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . 0.474 ' HA ' ' O ' ' A' ' 126' ' ' ASP . 51.3 mm -87.31 130.84 36.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . 0.415 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -60.56 123.81 75.79 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.92 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . 0.461 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 31.6 Cg_exo -60.22 154.72 50.22 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.967 2.445 . . . . 0.0 112.465 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . 0.438 ' HA ' ' HD3' ' A' ' 408' ' ' PRO . 21.5 m-85 -87.25 148.24 44.32 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.989 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . 0.495 ' HG3' ' SD ' ' A' ' 101' ' ' MET . 9.9 Cg_exo -70.71 138.51 34.94 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.995 2.463 . . . . 0.0 112.089 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -143.14 177.55 8.31 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 177.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -93.53 110.74 22.31 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.861 0.363 . . . . 0.0 110.379 179.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . 0.451 ' HB1' HG21 ' A' ' 100' ' ' VAL . . . -80.5 -91.9 0.05 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.741 179.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.428 ' H ' ' HB2' ' A' ' 411' ' ' ALA . 14.1 tp -131.08 120.25 18.19 Favored Pre-proline 0 C--N 1.325 -0.458 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 178.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -62.12 121.28 9.25 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.221 1.948 . . . . 0.0 111.259 175.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 414' ' ' THR . . . . . 0.469 HG22 ' O ' ' A' ' 85' ' ' GLY . 6.5 m -75.62 153.74 37.09 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.459 -175.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.232 0.164 0 C-N-CA 123.478 0.711 . . . . 0.0 110.957 177.605 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.527 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.3 OUTLIER . . . . . 0 N--CA 1.463 0.222 0 CA-C-O 121.259 0.552 . . . . 0.0 109.827 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.723 ' HB3' ' HB1' ' A' ' 86' ' ' ALA . 0.1 OUTLIER -145.75 14.41 1.37 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.922 -178.668 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 49.65 -108.61 0.32 Allowed 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.973 -171.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.21 106.58 2.01 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 172.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.488 ' HA ' HD13 ' A' ' 80' ' ' LEU . 0.8 OUTLIER -47.02 113.96 0.76 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 122.795 0.438 . . . . 0.0 111.778 -176.248 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.11 -73.73 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.566 176.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -136.41 127.22 4.07 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.641 -0.79 . . . . 0.0 113.031 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.723 ' HB1' ' HB3' ' A' ' 80' ' ' LEU . . . -149.06 165.25 32.25 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 177.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.33 139.51 39.21 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -20.01 51.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.002 -171.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.698 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -77.79 -43.61 30.1 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.981 -0.288 . . . . 0.0 111.461 -174.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.413 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 26.9 p -103.21 -64.65 1.06 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.137 0.494 . . . . 0.0 110.36 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.527 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 118.11 45.81 0.48 Allowed Glycine 0 N--CA 1.443 -0.892 0 C-N-CA 120.932 -0.651 . . . . 0.0 111.733 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.404 ' NE2' ' H ' ' A' ' 93' ' ' SER . 0.0 OUTLIER -123.42 145.21 48.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.864 0.364 . . . . 0.0 110.261 179.231 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.592 ' HB3' HG23 ' A' ' 414' ' ' THR . 0.0 OUTLIER -67.86 143.03 55.92 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.641 176.766 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.602 HG22 HG13 ' A' ' 100' ' ' VAL . 3.6 mt -111.86 101.84 52.31 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.716 -178.087 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.38 168.45 22.87 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 123.234 2.623 . . . . 0.0 111.519 173.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.49 4.37 4.92 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -175.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -96.67 -17.94 20.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.297 0.57 . . . . 0.0 110.07 177.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -102.86 153.31 20.31 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.327 -174.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -109.67 143.87 38.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.974 0.416 . . . . 0.0 110.921 -176.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.602 HG13 HG22 ' A' ' 94' ' ' ILE . 0.0 OUTLIER -129.0 162.19 36.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.785 -179.482 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.49 113.66 23.12 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.972 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -104.68 117.16 33.4 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.647 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -79.27 -59.76 2.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.768 176.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.28 114.25 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.389 176.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.43 -70.14 3.01 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.257 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -89.85 152.73 21.12 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.822 0.344 . . . . 0.0 110.492 -179.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.456 HG23 ' HB ' ' A' ' 100' ' ' VAL . 3.6 p -119.88 145.5 26.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.345 -177.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . 0.489 ' HD1' ' HB2' ' A' ' 89' ' ' ALA . 86.7 m-85 -137.99 -175.56 4.14 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.781 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.873 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 26.3 m80 -106.38 -179.72 4.02 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.383 -0.228 . . . . 0.0 110.383 179.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.37 -41.96 88.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.132 0.491 . . . . 0.0 110.187 178.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.667 ' HE2' ' SG ' ' A' ' 112' ' ' CYS . 0.1 OUTLIER -80.02 -28.35 39.36 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.367 179.134 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.873 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 27.6 m -79.64 -16.32 56.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.182 -178.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . 0.573 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.0 OUTLIER -76.67 82.15 3.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.251 178.257 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.651 HG23 ' HA ' ' A' ' 121' ' ' ARG . 1.0 OUTLIER -136.35 158.24 44.9 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.131 -178.263 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.525 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 3.4 p -72.26 152.19 42.33 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 176.097 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 2.4 m -87.27 5.44 38.3 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -175.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -114.61 -50.63 2.78 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -176.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.747 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -115.11 6.99 15.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.809 0.338 . . . . 0.0 110.495 -177.959 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.475 ' HG3' ' O ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER 52.13 40.18 28.16 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.266 -179.074 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . 0.71 HD21 ' HB2' ' A' ' 137' ' ' CYS . 40.1 t30 -81.33 130.13 34.91 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.558 178.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.651 ' HA ' HG23 ' A' ' 114' ' ' THR . 0.6 OUTLIER -76.5 123.21 25.69 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.945 -175.918 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.439 HD13 ' HD2' ' A' ' 128' ' ' PHE . 4.6 mt -80.19 138.21 36.82 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.063 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -134.43 139.89 34.11 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.455 -174.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . 0.422 ' HB3' ' CE2' ' A' ' 407' ' ' PHE . 52.8 Cg_exo -54.26 118.95 5.58 Favored 'Trans proline' 0 N--CA 1.463 -0.305 0 C-N-CA 122.575 2.183 . . . . 0.0 111.425 173.417 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 100.27 -0.27 55.89 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.53 -176.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -119.58 -173.35 2.51 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.727 0.299 . . . . 0.0 110.328 177.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -91.88 126.46 36.98 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.984 0.421 . . . . 0.0 111.166 -172.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.467 ' O ' ' HB2' ' A' ' 208' ' ' SER . 0.0 OUTLIER -137.08 135.36 37.41 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 174.802 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -124.07 115.98 22.05 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.142 0.496 . . . . 0.0 111.13 -177.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.455 ' HB2' ' CZ ' ' A' ' 128' ' ' PHE . 6.2 t80 -103.47 101.41 11.3 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 178.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 4.6 mt -118.92 115.28 47.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.622 -176.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 3.3 m120 58.9 31.76 21.61 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.375 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.405 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 80.61 34.36 28.47 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.442 -0.885 . . . . 0.0 112.687 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.486 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 0.4 OUTLIER -139.69 140.17 36.78 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 -179.55 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.3 mt -91.1 122.23 33.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.073 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.525 ' HA ' ' HB2' ' A' ' 115' ' ' CYS . 70.6 m-85 -128.74 158.88 37.37 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.622 176.25 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . 0.71 ' HB2' HD21 ' A' ' 120' ' ' ASN . 8.5 p -114.08 -168.97 1.43 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.017 0.437 . . . . 0.0 111.35 -177.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.25 -22.47 48.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.053 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . 0.704 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 37.2 m-70 -78.16 -28.93 48.4 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 120.997 0.427 . . . . 0.0 110.574 -176.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.747 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 0.8 OUTLIER -123.02 29.04 6.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.471 -178.6 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . 0.418 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 45.0 ttt180 -51.55 111.19 2.21 Favored Pre-proline 0 N--CA 1.469 0.521 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.706 -178.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 1.0 OUTLIER -84.81 83.08 1.63 Allowed 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 123.366 2.71 . . . . 0.0 112.17 -178.78 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' THR . . . . . 0.638 ' HA ' HD12 ' A' ' 146' ' ' ILE . 0.1 OUTLIER -67.8 -1.02 4.71 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -178.586 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -67.46 -17.34 64.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.799 0.333 . . . . 0.0 111.385 179.212 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.402 ' HB3' ' H ' ' A' ' 146' ' ' ILE . 3.9 tp -143.21 -102.37 0.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.685 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.638 HD12 ' HA ' ' A' ' 143' ' ' THR . 56.4 mt . . . . . 0 N--CA 1.465 0.304 0 CA-C-O 121.059 0.457 . . . . 0.0 111.292 -175.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.687 0 N-CA-C 110.974 -0.85 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 208' ' ' SER . . . . . 0.467 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 43.9 m -114.83 160.16 19.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.36 0.6 . . . . 0.0 111.311 -179.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . 0.498 HG22 HD12 ' A' ' 404' ' ' ILE . 5.4 mm -111.57 138.16 41.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.357 178.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -58.8 123.87 70.35 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-O 120.909 0.385 . . . . 0.0 111.532 -178.063 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . 0.573 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 31.4 Cg_exo -59.81 161.61 17.98 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.293 2.662 . . . . 0.0 112.491 177.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . 0.422 ' CE2' ' HB3' ' A' ' 124' ' ' PRO . 34.1 m-85 -94.77 156.46 38.19 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.481 -177.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.3 140.46 44.45 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.895 2.397 . . . . 0.0 112.752 179.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -144.82 175.78 9.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.516 178.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -98.08 109.74 22.44 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 174.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -85.77 -89.35 0.11 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.447 -175.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.477 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 2.1 tp -131.21 128.88 22.26 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.157 -178.021 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 3.2 Cg_exo -75.6 155.41 40.19 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.911 2.407 . . . . 0.0 111.913 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 414' ' ' THR . . . . . 0.592 HG23 ' HB3' ' A' ' 93' ' ' SER . 0.2 OUTLIER -83.06 176.5 9.18 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.772 177.055 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.179 177.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.427 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.1 OUTLIER . . . . . 0 CA--C 1.519 -0.227 0 CA-C-O 121.249 0.547 . . . . 0.0 110.329 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.702 HD11 ' H ' ' A' ' 84' ' ' SER . 1.5 pt? -98.86 155.31 17.45 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.597 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -73.22 -78.96 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.849 0.356 . . . . 0.0 111.077 -176.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -77.27 96.58 1.24 Allowed Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.473 -0.87 . . . . 0.0 111.17 175.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.493 ' HA ' HD11 ' A' ' 80' ' ' LEU . 58.4 t30 -56.41 100.69 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.229 0.537 . . . . 0.0 111.865 -174.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.702 ' H ' HD11 ' A' ' 80' ' ' LEU . 4.4 m -153.99 -62.15 0.13 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.708 175.53 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -141.73 118.56 1.34 Allowed Glycine 0 C--N 1.333 0.399 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.735 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.471 ' HB3' ' HB3' ' A' ' 80' ' ' LEU . . . -135.78 149.25 49.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.761 0.315 . . . . 0.0 110.424 179.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.826 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 3.3 t -57.18 145.93 29.77 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.262 177.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.5 m -99.63 -1.38 38.19 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.861 172.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.655 ' HB1' ' HB3' ' A' ' 112' ' ' CYS . . . -102.22 -59.26 1.73 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.014 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 30.7 p -93.98 -31.6 14.19 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 120.265 -0.574 . . . . 0.0 109.862 176.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.826 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 92.83 14.45 55.05 Favored Glycine 0 N--CA 1.45 -0.394 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.953 172.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -89.69 146.84 24.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.722 0.261 . . . . 0.0 110.759 178.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.533 ' HB2' HG21 ' A' ' 414' ' ' THR . 0.0 OUTLIER -66.08 140.31 58.24 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.457 176.984 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.7 mt -110.78 119.34 46.44 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -174.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -78.37 155.53 28.66 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.938 2.425 . . . . 0.0 110.628 167.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.552 ' HB3' ' HG3' ' A' ' 413' ' ' PRO . . . -68.07 -15.23 63.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.972 0.415 . . . . 0.0 111.116 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.94 -5.37 53.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.633 178.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -111.43 120.22 41.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.638 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.5 tp -76.1 128.53 35.18 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.968 0.413 . . . . 0.0 110.786 -178.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -116.59 140.02 40.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.335 -179.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.94 112.6 20.3 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.397 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.45 ' HD3' ' OE2' ' A' ' 409' ' ' GLU . 0.0 OUTLIER -88.42 150.46 23.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.175 -176.118 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -130.58 -134.78 0.21 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.331 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.73 69.75 3.14 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.093 0.473 . . . . 0.0 110.561 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 85.42 -25.79 6.14 Favored Glycine 0 N--CA 1.452 -0.275 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.435 179.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -89.35 156.14 18.9 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.734 0.302 . . . . 0.0 111.044 -177.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.29 132.59 67.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.791 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . 0.426 ' HD1' ' HB3' ' A' ' 89' ' ' ALA . 44.8 m-85 -128.15 171.28 12.07 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.332 176.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.917 ' H ' ' HB2' ' A' ' 112' ' ' CYS . 23.8 m80 -101.36 179.22 4.42 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 177.159 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.7 mt -62.34 -28.61 69.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.227 0.537 . . . . 0.0 110.698 177.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.506 ' HG3' ' H ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.06 -34.37 15.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.289 176.919 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.917 ' HB2' ' H ' ' A' ' 109' ' ' HIS . 4.2 m -78.78 -5.7 54.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.836 -175.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -96.38 66.0 2.37 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 172.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.826 HG21 ' HA ' ' A' ' 121' ' ' ARG . 0.5 OUTLIER -119.97 158.03 27.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.76 -178.95 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.556 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 5.6 t -62.61 152.5 34.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.292 173.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.2 m -87.1 -32.89 19.67 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.799 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -99.12 -51.59 3.79 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -174.006 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.466 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 8.3 p -90.23 -20.33 23.13 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.89 0.376 . . . . 0.0 110.116 178.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.556 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 69.52 25.28 5.4 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.844 175.201 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . 0.466 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 5.1 m-80 -70.1 128.35 35.99 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 174.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.826 ' HA ' HG21 ' A' ' 114' ' ' THR . 9.7 ttp85 -65.64 116.99 7.45 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 176.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 19.9 mt -65.5 151.99 45.07 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.731 0.301 . . . . 0.0 110.345 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 90.7 t -123.47 131.31 24.3 Favored Pre-proline 0 C--N 1.325 -0.466 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.651 -171.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -65.01 110.43 1.5 Allowed 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 121.814 1.676 . . . . 0.0 110.596 172.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.52 -17.05 14.15 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.415 -173.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -117.33 -161.18 0.8 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.82 150.34 27.9 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -169.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.538 ' O ' ' HB2' ' A' ' 208' ' ' SER . 0.0 OUTLIER -157.62 135.82 11.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.251 172.175 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -126.09 128.59 47.6 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.89 0.376 . . . . 0.0 110.574 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -124.81 102.56 7.62 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.836 -178.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.732 HD13 ' HG2' ' A' ' 142' ' ' PRO . 2.6 mp -131.32 130.43 63.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 -179.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.51 32.14 20.42 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 123.463 0.477 . . . . 0.0 110.248 -179.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 64.87 36.09 92.68 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.523 -177.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -131.62 147.85 52.56 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.464 -0.433 . . . . 0.0 109.884 -179.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 13.7 mt -101.26 115.06 29.63 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.322 -174.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -122.16 173.32 7.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.67 174.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . 0.765 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 29.4 p -119.09 -165.93 1.2 Allowed 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 177.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.09 -25.99 47.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.265 0.555 . . . . 0.0 109.51 175.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . 0.765 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 68.4 t60 -74.57 -24.34 58.9 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.256 -0.884 . . . . 0.0 108.738 176.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.462 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 1.7 m-20 -113.8 23.73 12.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.486 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 24.5 ttt-85 -62.88 115.14 15.13 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.125 -175.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . 0.732 ' HG2' HD13 ' A' ' 131' ' ' ILE . 44.9 Cg_exo -56.89 114.87 2.12 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.042 2.494 . . . . 0.0 112.645 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -18.25 56.95 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.762 -179.016 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -99.05 -98.88 0.22 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.251 -175.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.42 75.84 10.2 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.326 -176.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.402 ' H ' HG21 ' A' ' 146' ' ' ILE . 5.4 tt . . . . . 0 C--N 1.324 -0.538 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 175.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.487 0 N-CA-C 111.634 -0.586 . . . . 0.0 111.634 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 208' ' ' SER . . . . . 0.538 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -120.66 138.66 53.82 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.947 0.403 . . . . 0.0 111.431 -178.849 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 35.5 mm -101.06 142.16 16.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.836 178.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . 0.424 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -52.9 136.52 46.48 Favored Pre-proline 0 C--O 1.233 0.218 0 CA-C-O 120.757 0.313 . . . . 0.0 111.209 177.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . 0.488 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 11.7 Cg_exo -72.17 2.17 5.24 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.521 2.814 . . . . 0.0 113.335 -174.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . 0.488 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 10.0 m-85 73.89 156.95 0.16 Allowed Pre-proline 0 N--CA 1.469 0.505 0 O-C-N 123.673 0.608 . . . . 0.0 111.395 178.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -83.71 136.02 7.1 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.882 2.388 . . . . 0.0 112.05 177.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . 0.45 ' OE2' ' HD3' ' A' ' 102' ' ' ARG . 1.0 OUTLIER -137.87 177.82 7.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.162 179.358 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -97.31 126.55 42.6 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.786 0.327 . . . . 0.0 110.626 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -94.84 -168.25 1.78 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.377 178.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.439 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.4 OUTLIER -71.86 128.62 89.22 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.394 179.708 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . 0.552 ' HG3' ' HB3' ' A' ' 96' ' ' ALA . 10.0 Cg_exo -72.2 130.42 16.4 Favored 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 122.959 2.439 . . . . 0.0 112.626 -175.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 414' ' ' THR . . . . . 0.533 HG21 ' HB2' ' A' ' 93' ' ' SER . 0.4 OUTLIER -79.29 161.18 26.45 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.1 178.122 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.535 0.386 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 . . . . . 0 C--O 1.228 -0.051 0 CA-C-O 121.003 0.43 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.658 ' HB2' ' HA ' ' A' ' 83' ' ' ASN . 0.8 OUTLIER -140.46 131.14 25.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.757 -177.867 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -81.1 104.41 11.57 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 176.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.43 5.43 86.99 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.468 -0.873 . . . . 0.0 111.892 -177.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.658 ' HA ' ' HB2' ' A' ' 80' ' ' LEU . 23.5 t-20 59.7 55.6 3.92 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.133 0.492 . . . . 0.0 111.434 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 29.1 m -157.96 107.4 2.09 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.415 175.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.36 133.29 1.79 Allowed Glycine 0 CA--C 1.519 0.328 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.824 178.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.527 ' HB2' HD21 ' A' ' 80' ' ' LEU . . . -167.4 150.71 6.28 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 177.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.93 145.96 30.61 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.15 -10.76 59.06 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.08 -170.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.589 ' CB ' ' HB3' ' A' ' 112' ' ' CYS . . . -85.14 -46.91 10.66 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.164 -176.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.553 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 30.5 p -102.95 -77.35 0.56 Allowed 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.873 -178.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.553 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 147.33 -1.12 0.72 Allowed Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.742 -177.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -83.21 146.02 28.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.895 0.379 . . . . 0.0 110.181 177.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 86' ' ' ALA . 1.2 m -76.48 169.09 18.91 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.159 176.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.546 HG12 HG13 ' A' ' 100' ' ' VAL . 2.7 mt -111.25 104.74 56.52 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-O 120.744 0.307 . . . . 0.0 111.244 -176.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.909 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 2.9 Cg_exo -76.29 167.75 25.22 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.853 2.369 . . . . 0.0 111.012 173.039 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.24 -9.01 51.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.06 0.457 . . . . 0.0 111.195 -178.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.31 -10.77 34.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.876 178.332 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.909 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 3.3 mm-40 -101.81 163.13 12.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.506 -179.333 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.671 ' HB2' HD12 ' A' ' 110' ' ' LEU . 10.3 mt -132.66 133.75 43.97 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.524 -178.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.546 HG13 HG12 ' A' ' 94' ' ' ILE . 2.0 m -118.21 148.97 20.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.828 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.501 ' HE2' ' HD2' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -95.64 121.97 37.91 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 175.844 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.524 ' HA ' HG13 ' A' ' 107' ' ' VAL . 14.4 ttt85 -88.52 129.21 35.52 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.47 -175.301 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -112.22 -147.93 0.42 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.59 77.79 2.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.934 0.397 . . . . 0.0 110.736 178.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.5 -42.39 2.7 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.857 -0.611 . . . . 0.0 112.603 176.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -89.7 156.24 18.68 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.838 0.351 . . . . 0.0 110.797 -178.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.524 HG13 ' HA ' ' A' ' 102' ' ' ARG . 0.4 OUTLIER -127.95 148.87 32.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.592 179.688 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -136.63 149.92 48.25 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 178.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.884 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 33.9 m80 -71.35 171.35 11.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.902 0.382 . . . . 0.0 110.798 -177.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.671 HD12 ' HB2' ' A' ' 99' ' ' LEU . 0.3 OUTLIER -61.26 -26.19 67.59 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.101 0.477 . . . . 0.0 111.171 175.971 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.448 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.82 -20.64 22.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.881 177.478 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.884 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 7.5 m -100.31 -18.65 16.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.184 -170.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . 0.501 ' HD2' ' HE2' ' A' ' 101' ' ' MET . 1.5 t80 -67.6 83.57 0.18 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.086 0.47 . . . . 0.0 110.201 176.502 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 2.5 p -135.67 160.63 37.91 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.528 -174.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.541 ' HB3' ' H ' ' A' ' 120' ' ' ASN . 37.2 t -60.88 154.18 22.86 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.626 177.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 1.2 m -95.64 -10.39 29.53 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.092 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -107.94 -52.48 2.76 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.839 -0.345 . . . . 0.0 111.815 -179.444 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.413 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -98.97 -20.09 16.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.11 0.481 . . . . 0.0 109.96 179.124 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.509 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.1 OUTLIER 64.94 37.54 6.91 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.891 -178.288 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . 0.542 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 72.8 m-20 -75.53 140.95 43.05 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 174.394 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.6 112.41 14.37 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 176.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.461 HD12 ' HB2' ' A' ' 128' ' ' PHE . 10.0 mt -70.7 152.46 43.81 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.362 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.419 HG11 ' N ' ' A' ' 124' ' ' PRO . 8.9 t -119.09 135.04 23.65 Favored Pre-proline 0 C--N 1.325 -0.468 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.955 -168.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . 0.419 ' N ' HG11 ' A' ' 123' ' ' VAL . 40.2 Cg_exo -56.99 111.59 0.85 Allowed 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 122.581 2.187 . . . . 0.0 111.207 174.264 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.59 5.9 56.6 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.513 -178.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -126.05 -173.95 2.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.757 0.313 . . . . 0.0 111.043 177.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.449 ' HA ' ' O ' ' A' ' 208' ' ' SER . 6.9 mmt-85 -73.86 136.64 43.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.383 0.611 . . . . 0.0 112.294 -171.131 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.461 ' HB2' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -148.84 153.28 37.86 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.966 -1.015 . . . . 0.0 108.578 175.517 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -135.45 133.62 38.76 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.492 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.401 ' HA ' ' O ' ' A' ' 134' ' ' SER . 5.1 t80 -126.17 102.11 7.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.378 175.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 2.8 mp -127.68 128.04 69.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 -178.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.5 m120 61.02 32.56 19.86 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.579 0.549 . . . . 0.0 111.016 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 68.07 35.27 83.4 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.436 -0.888 . . . . 0.0 112.037 -178.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.401 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.7 OUTLIER -138.41 146.91 42.77 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -178.253 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 9.6 mt -99.34 129.12 45.52 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.899 0.38 . . . . 0.0 110.617 -176.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -129.44 161.24 30.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.501 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . 0.542 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 6.1 m -93.31 176.1 6.52 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.059 0.456 . . . . 0.0 109.831 175.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.95 -14.22 59.61 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 162.247 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . 0.449 ' HB3' ' HB2' ' A' ' 137' ' ' CYS . 67.8 t60 -70.11 -46.83 63.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.129 -1.396 . . . . 0.0 110.517 177.221 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.413 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 1.9 p-10 -109.83 13.52 23.54 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.281 -177.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . 0.435 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 22.2 ttt-85 -47.55 114.4 3.1 Favored Pre-proline 0 N--CA 1.468 0.445 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.998 -177.201 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 6.0 Cg_exo -79.85 118.92 3.86 Favored 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 123.286 2.657 . . . . 0.0 112.262 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -11.21 60.66 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -99.24 -18.61 17.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.949 0.404 . . . . 0.0 111.355 -179.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 1.2 mt -127.79 83.4 2.16 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.009 0.433 . . . . 0.0 110.31 -178.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.035 -179.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.459 0 N-CA-C 112.588 -0.205 . . . . 0.0 112.588 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 208' ' ' SER . . . . . 0.449 ' O ' ' HA ' ' A' ' 127' ' ' ARG . 0.0 OUTLIER -73.09 148.58 43.86 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.862 0.363 . . . . 0.0 110.599 178.731 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 48.3 mm -104.42 136.89 35.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.348 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -60.82 126.11 84.67 Favored Pre-proline 0 C--N 1.33 -0.261 0 O-C-N 123.42 0.45 . . . . 0.0 109.955 176.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . 0.559 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 82.9 Cg_exo -44.05 -71.06 0.06 OUTLIER 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.722 2.948 . . . . 0.0 113.133 -173.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . 0.559 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 0.2 OUTLIER 149.92 157.93 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.691 0 C-N-CA 125.185 1.394 . . . . 0.0 108.739 177.558 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . 0.505 ' HD2' ' CD2' ' A' ' 407' ' ' PHE . 39.7 Cg_exo -61.42 132.29 40.23 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.692 2.261 . . . . 0.0 112.05 174.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -138.4 154.38 48.91 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.956 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -86.73 130.84 34.32 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 176.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . 0.445 ' HB2' ' H ' ' A' ' 412' ' ' LEU . . . -107.38 -120.3 0.25 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.258 -177.334 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.445 ' H ' ' HB2' ' A' ' 411' ' ' ALA . 0.2 OUTLIER -96.38 129.13 34.23 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.156 -179.217 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 20.7 Cg_exo -66.17 151.23 84.13 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 123.213 2.609 . . . . 0.0 112.771 -177.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 26.5 m -68.32 141.96 55.65 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.815 177.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 12.6 p . . . . . 0 N--CA 1.467 0.376 0 O-C-N 124.094 0.871 . . . . 0.0 111.704 179.889 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.7 ttp180 . . . . . 0 N--CA 1.454 -0.238 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.624 ' HB3' ' HA ' ' A' ' 83' ' ' ASN . 2.6 mm? -105.77 117.53 34.26 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 114.582 -1.19 . . . . 0.0 110.681 -173.056 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -70.36 -48.5 56.04 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.706 178.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -102.87 -12.8 31.19 Favored Glycine 0 N--CA 1.454 -0.155 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.203 178.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.624 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 1.4 t30 67.77 37.36 3.23 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.083 0.468 . . . . 0.0 111.243 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -116.16 -69.84 0.83 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.801 179.233 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . 0.438 ' O ' ' HA ' ' A' ' 93' ' ' SER . . . -133.64 143.42 15.1 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.983 -0.627 . . . . 0.0 111.999 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -147.88 170.77 16.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.708 0.254 . . . . 0.0 110.679 -177.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.662 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 50.4 t -75.01 145.77 42.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.567 179.144 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.7 m -80.93 -9.6 59.81 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.372 176.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -113.75 -58.01 2.21 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.802 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 37.7 m -71.19 -43.04 68.2 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.481 0.658 . . . . 0.0 109.972 178.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.662 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 87.2 0.28 85.21 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.586 -176.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.03 132.37 38.91 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.438 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 0.0 OUTLIER -57.89 123.38 15.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 175.917 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.575 HG23 HG13 ' A' ' 100' ' ' VAL . 8.0 mt -79.24 117.13 65.27 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.26 -176.294 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.537 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 2.7 Cg_exo -77.66 158.89 31.97 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 123.098 2.532 . . . . 0.0 111.271 174.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.409 ' HB2' ' HB3' ' A' ' 413' ' ' PRO . . . -66.37 -21.76 66.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.226 0.536 . . . . 0.0 111.001 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.96 2.39 30.95 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.509 -179.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.537 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -107.88 159.32 16.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.075 0.464 . . . . 0.0 110.904 -178.732 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.2 mt -121.42 124.66 45.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.574 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.575 HG13 HG23 ' A' ' 94' ' ' ILE . 19.2 m -123.44 169.51 14.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.135 -173.761 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -115.77 112.26 21.75 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.22 0.533 . . . . 0.0 109.943 178.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.71 98.06 10.18 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.261 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -74.64 -45.37 45.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.504 178.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.495 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -161.53 -129.18 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -179.988 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.495 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -66.24 -22.37 70.88 Favored Glycine 0 N--CA 1.451 -0.326 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 173.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -89.15 135.37 33.6 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 2.5 p -123.12 128.24 74.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.442 -177.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . 0.544 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 38.7 m-85 -125.49 176.61 6.71 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.147 -179.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.789 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 70.4 m80 -99.42 -149.58 0.36 Allowed 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 175.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.459 ' H ' ' HG ' ' A' ' 110' ' ' LEU . 0.0 OUTLIER -86.87 -30.12 21.66 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.146 174.4 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.8 -34.02 16.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.797 0.332 . . . . 0.0 111.863 -172.239 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.789 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.1 OUTLIER -75.74 -19.4 59.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.261 0.553 . . . . 0.0 110.498 -176.402 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -76.41 72.31 3.13 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.412 176.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.1 p -137.79 157.95 45.37 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.453 -178.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.454 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 11.4 p -79.02 154.25 29.62 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 120.867 0.365 . . . . 0.0 110.247 176.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -53.78 18.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -174.128 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.6 -50.8 14.43 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -168.164 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.31 -13.58 19.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.595 0.236 . . . . 0.0 111.422 -175.249 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.454 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.9 OUTLIER 63.33 42.98 6.44 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.658 -179.389 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -77.99 122.7 25.88 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.408 176.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.25 122.68 22.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.733 0.301 . . . . 0.0 110.683 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.443 HD22 ' HB2' ' A' ' 128' ' ' PHE . 8.9 mt -71.83 143.08 49.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 176.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.3 t -139.17 138.36 20.73 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-O 121.031 0.443 . . . . 0.0 111.568 -166.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.3 110.98 1.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.576 2.184 . . . . 0.0 110.865 175.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 120.77 -15.86 9.61 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 -175.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -113.72 -159.44 0.69 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 127' ' ' ARG . 0.0 OUTLIER -118.99 129.36 55.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.158 0.504 . . . . 0.0 111.444 -175.754 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.443 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.6 OUTLIER -117.53 138.64 51.76 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 172.538 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -104.88 108.98 20.76 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.93 0.395 . . . . 0.0 111.068 -177.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -95.77 100.86 12.52 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 174.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 57.1 mt -122.95 122.88 66.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.089 -175.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.4 t30 58.85 28.77 17.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.599 -176.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 73.38 32.66 59.68 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.34 -178.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 3.9 m -132.57 155.92 47.8 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 -177.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 67.3 mt -95.72 116.62 29.14 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 123.242 0.339 . . . . 0.0 110.821 -176.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -125.79 150.83 47.47 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.916 177.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . 0.548 ' SG ' ' HB2' ' A' ' 139' ' ' HIS . 17.8 p -99.47 -172.39 2.25 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.357 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -77.56 -20.83 53.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.873 0.368 . . . . 0.0 110.744 177.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . 0.548 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 1.0 OUTLIER -81.81 -38.82 24.95 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 178.252 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.418 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 2.0 m-20 -74.74 -31.24 61.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.586 178.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -20.79 101.88 0.07 OUTLIER Pre-proline 0 N--CA 1.47 0.538 0 O-C-N 125.294 1.621 . . . . 0.0 114.103 -177.033 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -70.74 162.61 41.98 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 122.901 2.401 . . . . 0.0 112.322 176.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' THR . . . . . 0.417 ' O ' ' HB2' ' A' ' 144' ' ' ALA . 98.4 m -110.12 150.4 28.65 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.89 176.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 143' ' ' THR . . . 73.94 -62.04 0.48 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.399 0.679 . . . . 0.0 111.607 178.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.62 62.29 7.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.094 0.473 . . . . 0.0 110.206 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.458 ' H ' HG13 ' A' ' 146' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.578 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.311 178.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.645 0 N-CA-C 111.868 -0.493 . . . . 0.0 111.868 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.09 162.74 34.21 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 -177.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . 0.428 ' O ' ' HD1' ' A' ' 128' ' ' PHE . 15.4 mm -125.05 -94.03 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 O-C-N 123.292 0.37 . . . . 0.0 110.067 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . 0.435 ' HA ' ' CD1' ' A' ' 128' ' ' PHE . . . -169.9 157.34 6.25 Favored Pre-proline 0 C--O 1.234 0.244 0 N-CA-C 110.41 -0.219 . . . . 0.0 110.41 -177.224 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . 0.483 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 73.6 Cg_endo -77.76 -19.3 12.78 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.293 1.995 . . . . 0.0 111.318 174.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . 0.483 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 4.4 m-85 76.17 149.93 0.13 Allowed Pre-proline 0 CA--C 1.533 0.312 0 O-C-N 124.419 1.074 . . . . 0.0 111.381 177.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.38 116.54 4.35 Favored 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.564 2.176 . . . . 0.0 112.646 178.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -136.8 177.31 7.96 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.927 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -89.58 134.33 34.18 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.144 -179.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -107.21 -166.38 1.15 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.429 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 2.4 mp -67.64 122.49 83.65 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.321 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 7.0 Cg_exo -72.92 135.85 24.05 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 123.088 2.525 . . . . 0.0 113.04 -175.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 414' ' ' THR . . . . . 0.436 HG22 ' N ' ' A' ' 415' ' ' SER . 0.4 OUTLIER -67.08 153.39 43.78 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.601 176.06 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 415' ' ' SER . . . . . 0.436 ' N ' HG22 ' A' ' 414' ' ' THR . 1.1 m . . . . . 0 N--CA 1.463 0.187 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.163 0 CA-C-O 121.337 0.589 . . . . 0.0 110.085 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.575 ' HG ' ' HB1' ' A' ' 86' ' ' ALA . 5.1 mp -99.53 14.42 29.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.72 -173.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.544 ' HB2' ' OG ' ' A' ' 93' ' ' SER . 0.2 OUTLIER 47.58 56.25 7.31 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 123.624 0.578 . . . . 0.0 112.184 176.322 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.33 5.2 59.34 Favored Glycine 0 C--N 1.327 0.046 0 C-N-CA 120.429 -0.891 . . . . 0.0 111.981 -178.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.455 ' HA ' ' CB ' ' A' ' 80' ' ' LEU . 61.3 t30 69.24 65.49 0.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 123.68 0.792 . . . . 0.0 112.285 175.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.507 ' CB ' ' HA ' ' A' ' 414' ' ' THR . 0.1 OUTLIER -106.36 -55.28 2.35 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.981 173.382 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -162.95 167.36 37.3 Favored Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.575 ' HB1' ' HG ' ' A' ' 80' ' ' LEU . . . -153.31 135.16 14.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.71 0.29 . . . . 0.0 110.661 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.441 ' HB2' ' CE1' ' A' ' 109' ' ' HIS . 19.0 t -67.4 145.43 55.04 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.336 175.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.7 m -79.11 -0.14 30.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.356 178.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -124.95 -55.78 1.58 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.68 -0.236 . . . . 0.0 111.188 176.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 25.4 m -76.37 -26.67 55.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.786 0.327 . . . . 0.0 111.137 -178.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.25 32.68 84.59 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.287 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.426 ' NE2' ' H ' ' A' ' 93' ' ' SER . 0.0 OUTLIER -119.63 162.5 18.87 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.631 0.253 . . . . 0.0 110.406 179.831 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.544 ' OG ' ' HB2' ' A' ' 81' ' ' PHE . 0.7 OUTLIER -78.64 171.09 15.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.998 -178.684 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.526 HG23 HG13 ' A' ' 100' ' ' VAL . 2.3 mp -127.44 119.68 21.84 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.058 -175.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.663 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 7.8 Cg_exo -74.11 167.53 26.96 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.817 2.345 . . . . 0.0 111.12 171.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.4 -12.4 61.39 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.086 0.469 . . . . 0.0 111.183 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.98 -14.03 34.88 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.168 -179.007 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.663 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -94.92 102.7 14.55 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.032 0.444 . . . . 0.0 110.966 -174.445 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 62.5 mt -71.66 126.59 30.1 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 173.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.646 ' HB ' ' O ' ' A' ' 108' ' ' TYR . 13.8 m -122.25 149.11 25.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.094 -174.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.28 153.75 21.76 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.402 ' HB3' HG11 ' A' ' 107' ' ' VAL . 0.0 OUTLIER -133.66 155.46 49.67 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.701 -178.054 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -124.38 -113.4 0.3 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.019 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -92.68 75.46 5.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.111 0.481 . . . . 0.0 110.688 -178.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.82 -39.12 3.09 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.748 178.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -89.74 167.22 13.05 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.671 0.272 . . . . 0.0 110.92 -178.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.402 HG11 ' HB3' ' A' ' 102' ' ' ARG . 2.5 m -124.0 160.99 27.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 121.356 0.598 . . . . 0.0 112.588 -173.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . 0.646 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 73.7 m-85 -139.32 -170.26 2.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.654 -1.157 . . . . 0.0 107.977 173.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.828 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 71.7 m80 -112.29 -155.06 0.56 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 173.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.403 ' H ' ' HB3' ' A' ' 109' ' ' HIS . 1.3 mm? -84.36 -25.31 29.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.139 0.495 . . . . 0.0 110.875 178.226 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.21 -32.84 16.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.084 -175.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.828 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -84.63 -16.34 42.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.655 -172.241 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -78.25 65.09 3.52 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.457 0.646 . . . . 0.0 110.624 179.239 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.707 HG23 ' HA ' ' A' ' 121' ' ' ARG . 12.1 p -121.35 164.52 16.93 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.892 -178.193 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.719 ' HB3' ' H ' ' A' ' 120' ' ' ASN . 41.3 t -60.24 152.74 24.02 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.203 172.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.97 -14.77 20.42 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.719 178.675 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.98 -50.94 4.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.594 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.561 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -106.63 -11.26 15.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.189 -178.35 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.617 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 61.61 36.2 16.85 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.592 -178.041 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . 0.719 ' H ' ' HB3' ' A' ' 115' ' ' CYS . 1.2 t30 -80.44 130.46 35.17 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 176.712 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.707 ' HA ' HG23 ' A' ' 114' ' ' THR . 1.6 ttp85 -76.29 117.83 18.37 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.887 0.375 . . . . 0.0 110.602 -177.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.4 mt -66.39 150.81 48.34 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.757 -177.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.469 HG11 ' N ' ' A' ' 124' ' ' PRO . 11.7 t -131.77 140.95 39.86 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.066 -171.489 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . 0.469 ' N ' HG11 ' A' ' 123' ' ' VAL . 11.1 Cg_endo -56.21 111.03 0.66 Allowed 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.375 2.05 . . . . 0.0 111.074 172.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.33 -19.58 13.04 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 -174.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -100.76 167.5 10.27 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 2.2 mtm-85 -106.52 145.89 31.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.02 0.438 . . . . 0.0 111.776 -173.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -129.11 149.24 51.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.861 174.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 87.8 m-70 -117.06 109.26 16.75 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.535 -177.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.472 ' HA ' ' O ' ' A' ' 134' ' ' SER . 1.6 t80 -92.7 102.22 14.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.066 0.46 . . . . 0.0 109.846 178.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.525 HD12 HG13 ' A' ' 146' ' ' ILE . 12.0 mt -123.13 122.66 66.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.874 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 62.3 26.47 15.83 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.665 0.603 . . . . 0.0 111.086 178.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 78.28 34.19 37.51 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.229 -179.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.472 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.4 OUTLIER -139.0 152.73 47.88 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -177.859 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.3 mt -102.39 114.08 27.96 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.481 -174.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.511 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 64.9 m-85 -109.44 150.51 27.99 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 174.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . 0.472 ' HB3' ' HB2' ' A' ' 115' ' ' CYS . 11.4 p -114.47 176.13 5.18 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.393 -176.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -68.22 -17.53 64.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.308 -175.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -75.18 -45.94 37.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.114 -176.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.561 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 10.2 p-10 -93.17 -39.48 11.0 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.069 -177.646 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 24.24 84.86 0.12 Allowed Pre-proline 0 N--CA 1.477 0.911 0 O-C-N 124.507 1.13 . . . . 0.0 113.761 176.209 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.38 134.29 63.38 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.767 2.311 . . . . 0.0 112.879 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' THR . . . . . 0.517 ' O ' HG22 ' A' ' 143' ' ' THR . 1.6 m -104.7 -25.71 12.58 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.102 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -68.63 -50.78 48.69 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.899 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.08 102.09 5.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.63 178.184 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . 0.525 HG13 HD12 ' A' ' 131' ' ' ILE . 2.3 tt . . . . . 0 C--N 1.323 -0.544 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.982 178.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.54 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.22 140.92 38.91 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.036 0.446 . . . . 0.0 111.274 -175.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 26.7 mm -71.55 146.89 11.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 172.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . 0.42 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -48.28 117.53 5.85 Favored Pre-proline 0 C--N 1.33 -0.26 0 O-C-N 123.313 0.383 . . . . 0.0 110.509 176.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . 0.443 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 14.6 Cg_exo -69.85 8.13 0.86 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.748 2.965 . . . . 0.0 113.732 -172.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . 0.443 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 33.2 m-85 71.07 159.71 0.16 Allowed Pre-proline 0 C--O 1.234 0.252 0 O-C-N 123.76 0.663 . . . . 0.0 111.248 178.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.28 132.05 13.4 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.791 2.327 . . . . 0.0 111.787 175.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.32 177.25 7.83 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.823 178.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -85.89 142.27 28.98 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.271 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -103.4 -134.15 0.32 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.778 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 1.1 mm? -100.17 124.99 41.29 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 178.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 34.2 Cg_exo -58.79 150.67 69.59 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 123.077 2.518 . . . . 0.0 112.705 179.223 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 414' ' ' THR . . . . . 0.507 ' HA ' ' CB ' ' A' ' 84' ' ' SER . 0.3 OUTLIER -67.67 149.78 49.57 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.297 -178.261 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 CA--C 1.531 0.233 0 CA-C-O 121.362 0.601 . . . . 0.0 112.134 179.733 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.668 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--O 1.227 -0.13 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.772 ' HB3' ' HB1' ' A' ' 86' ' ' ALA . 0.4 OUTLIER -126.79 169.13 13.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.71 0.29 . . . . 0.0 110.982 -176.538 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 -88.34 114.23 24.75 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.214 -178.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.476 ' HA3' ' CB ' ' A' ' 415' ' ' SER . . . 102.54 -33.92 6.15 Favored Glycine 0 C--N 1.33 0.247 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 -177.113 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . 0.418 ' HA ' ' HG ' ' A' ' 80' ' ' LEU . 2.3 t30 67.22 83.82 0.16 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 172.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -139.68 -43.06 0.44 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.153 173.446 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . 0.477 ' O ' HG21 ' A' ' 414' ' ' THR . . . -167.76 140.33 6.18 Favored Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 111.114 -0.794 . . . . 0.0 111.114 178.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.772 ' HB1' ' HB3' ' A' ' 80' ' ' LEU . . . -141.18 164.91 28.98 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 117.005 0.403 . . . . 0.0 111.488 -174.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.668 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 37.7 t -65.41 144.49 57.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.357 176.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.82 -15.97 61.62 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.007 178.685 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -111.21 -59.35 1.98 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.636 -0.257 . . . . 0.0 111.257 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 10.5 m -74.32 -43.61 56.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.35 0.595 . . . . 0.0 110.729 -179.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.668 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 81.62 12.58 81.49 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.962 -176.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -75.99 148.29 38.19 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.867 0.365 . . . . 0.0 110.854 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.509 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -69.55 129.27 39.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.9 176.147 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.5 mt -94.05 108.75 37.65 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-O 120.963 0.411 . . . . 0.0 111.048 -178.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.683 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 9.5 Cg_exo -72.76 167.19 27.87 Favored 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.772 2.314 . . . . 0.0 111.673 175.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.767 ' HB1' ' HB3' ' A' ' 413' ' ' PRO . . . -74.96 -3.76 34.18 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.995 0.426 . . . . 0.0 111.383 -179.211 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.31 -4.03 30.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.654 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.683 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.3 OUTLIER -94.11 123.4 37.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.304 -174.462 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.6 mt -89.45 114.7 26.22 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 173.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.515 HG23 ' HB2' ' A' ' 411' ' ' ALA . 0.1 OUTLIER -115.82 141.9 31.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.275 -171.194 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.543 ' HE1' ' HD2' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -82.61 111.39 18.54 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.632 -177.623 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.427 ' H ' ' HG3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -111.52 127.4 55.7 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.104 -176.538 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.56 -39.15 67.68 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.067 0.461 . . . . 0.0 110.083 176.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.436 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 1.8 tp-100 -171.73 -100.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.656 -179.111 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . 0.436 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -83.97 -17.98 64.16 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.934 -0.65 . . . . 0.0 111.724 177.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -101.99 149.4 24.27 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 9.7 p -122.7 148.45 26.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.221 -173.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -139.69 -170.25 2.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.656 177.08 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.758 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 69.1 m80 -114.17 -161.59 0.77 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 173.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.3 mp -85.35 -19.43 31.46 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.235 0.541 . . . . 0.0 111.037 179.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.491 ' HA ' ' NH1' ' A' ' 121' ' ' ARG . 0.0 OUTLIER -90.16 -38.41 13.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.436 -176.105 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.758 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.56 -28.29 56.21 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.366 -174.182 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . 0.543 ' HD2' ' HE1' ' A' ' 101' ' ' MET . 0.0 OUTLIER -71.45 82.23 0.79 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.038 -179.429 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.701 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.1 p -143.97 161.05 39.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.199 -176.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.564 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 1.7 t -67.62 142.23 56.5 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 173.59 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.98 -11.88 51.87 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.869 0.366 . . . . 0.0 111.091 -177.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.484 ' HB ' ' OD2' ' A' ' 140' ' ' ASP . 0.2 OUTLIER -91.62 -51.01 5.46 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -174.813 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.618 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 22.2 p -115.83 -7.42 12.05 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.886 0.374 . . . . 0.0 110.73 -178.245 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.564 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 70.99 27.4 3.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.981 -177.065 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . 0.618 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 3.7 t-20 -54.2 119.24 4.85 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.241 172.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.701 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.0 OUTLIER -69.39 108.24 3.65 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 177.277 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.678 HD22 ' HB2' ' A' ' 128' ' ' PHE . 40.4 mt -63.46 137.58 58.2 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -179.082 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 53.9 t -122.59 132.0 24.32 Favored Pre-proline 0 C--N 1.323 -0.573 0 C-N-CA 121.004 -0.279 . . . . 0.0 110.601 -172.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.44 110.88 0.78 Allowed 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.285 1.99 . . . . 0.0 110.638 173.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 110.45 -13.05 30.61 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.604 -175.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -108.0 172.43 6.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.762 0.315 . . . . 0.0 110.293 178.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.708 ' HB3' ' HB3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -79.15 138.24 37.81 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.056 -174.268 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.678 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -146.8 160.08 42.71 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.051 176.108 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . 0.592 ' HB3' HD13 ' A' ' 131' ' ' ILE . 8.3 m-70 -127.31 134.72 49.98 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.035 0.445 . . . . 0.0 111.035 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.558 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 12.9 t80 -124.22 103.21 8.11 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -179.783 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.592 HD13 ' HB3' ' A' ' 129' ' ' HIS . 0.0 OUTLIER -121.75 117.54 52.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.345 -179.635 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 52.7 t30 57.1 35.87 26.87 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.77 0.669 . . . . 0.0 110.842 177.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.558 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 75.21 35.53 48.42 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.617 -0.802 . . . . 0.0 113.109 179.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -130.75 139.17 50.23 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 117.126 0.463 . . . . 0.0 110.136 179.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 10.7 mt -94.55 116.14 28.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.081 0.467 . . . . 0.0 110.924 -177.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -125.69 159.76 31.43 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.307 177.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . 0.467 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 21.2 p -91.6 173.08 8.07 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 177.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.708 ' HB3' ' HB3' ' A' ' 127' ' ' ARG . 0.3 OUTLIER -74.76 -14.68 60.74 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 175.535 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . 0.467 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 15.4 t60 -84.46 -24.19 29.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.517 -177.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.484 ' OD2' ' HB ' ' A' ' 117' ' ' THR . 40.3 m-20 -120.77 17.88 11.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.349 -176.608 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 141' ' ' ARG . 4.5 ptm180 -53.67 120.81 24.42 Favored Pre-proline 0 C--O 1.235 0.305 0 CA-C-O 121.341 0.591 . . . . 0.0 111.307 -176.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 24.3 Cg_exo -64.13 128.99 23.01 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.908 2.405 . . . . 0.0 112.034 -179.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -98.06 -33.93 10.98 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.318 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -96.61 14.63 24.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.452 0.644 . . . . 0.0 110.471 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -146.0 55.93 1.18 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.603 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 7.0 tt . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.39 -176.448 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.647 0 N-CA-C 112.343 -0.303 . . . . 0.0 112.343 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.14 174.88 7.38 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 177.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 49.7 mm -104.62 136.16 39.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -61.37 124.2 79.66 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.764 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -57.14 150.85 54.49 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.885 2.39 . . . . 0.0 112.373 178.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -86.03 155.32 58.08 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.321 -174.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . 0.526 ' HA ' ' HA ' ' A' ' 101' ' ' MET . 64.6 Cg_endo -76.49 117.41 4.56 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.586 2.191 . . . . 0.0 112.054 175.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -127.44 166.86 17.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.792 -178.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -74.77 109.92 8.64 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 176.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . 0.515 ' HB2' HG23 ' A' ' 100' ' ' VAL . . . -89.83 -83.78 0.24 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.229 -174.361 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 412' ' ' LEU . 1.3 pt? -131.47 129.81 22.31 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.784 -176.034 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . 0.767 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 73.8 Cg_endo -80.68 121.18 4.08 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.509 2.139 . . . . 0.0 111.164 172.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 414' ' ' THR . . . . . 0.477 HG21 ' O ' ' A' ' 85' ' ' GLY . 32.4 p -93.47 -126.67 0.1 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -176.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 415' ' ' SER . . . . . 0.476 ' CB ' ' HA3' ' A' ' 82' ' ' GLY . 0.3 OUTLIER . . . . . 0 C--N 1.324 -0.522 0 CA-C-O 121.017 0.437 . . . . 0.0 111.767 -176.428 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.571 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER . . . . . 0 CA--C 1.522 -0.123 0 CA-C-O 121.061 0.458 . . . . 0.0 110.189 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.79 109.3 9.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.707 179.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.403 ' O ' HG21 ' A' ' 414' ' ' THR . 57.3 m-85 -78.16 93.89 4.64 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.483 0.659 . . . . 0.0 110.462 -177.23 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.512 ' HA3' ' HA ' ' A' ' 415' ' ' SER . . . 123.45 -20.11 7.47 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.073 -175.236 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 64.14 18.94 11.55 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.548 0.739 . . . . 0.0 112.302 176.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.403 ' OG ' ' HA ' ' A' ' 414' ' ' THR . 0.2 OUTLIER -91.74 -14.09 30.52 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.848 176.947 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 151.43 170.14 17.92 Favored Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.001 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -167.93 163.81 13.83 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 178.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.572 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 43.3 t -68.5 145.78 53.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.058 0.456 . . . . 0.0 110.111 175.284 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -94.74 -1.71 52.44 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.793 179.11 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -112.41 -51.68 2.83 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.866 0.365 . . . . 0.0 110.338 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 34.8 m -77.78 -52.89 8.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.843 175.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.572 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 96.82 1.76 59.9 Favored Glycine 0 N--CA 1.443 -0.845 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.768 -176.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.6 134.88 34.38 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 177.433 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' SER . . . . . 0.54 ' HB3' HG22 ' A' ' 414' ' ' THR . 1.0 OUTLIER -65.69 148.3 51.98 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.16 176.735 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.8 mt -103.37 116.18 62.56 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -168.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -77.53 167.28 24.55 Favored 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.833 2.355 . . . . 0.0 111.028 170.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.08 7.27 6.41 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -176.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.67 -35.67 14.81 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -175.836 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -96.49 127.32 42.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.881 0.372 . . . . 0.0 110.785 -176.305 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.69 125.2 29.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.64 176.486 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.768 ' HB ' ' O ' ' A' ' 108' ' ' TYR . 29.8 m -115.91 -172.48 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.244 -170.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.692 ' HE3' ' HG3' ' A' ' 124' ' ' PRO . 3.8 mmt -122.59 112.7 18.31 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.005 0.431 . . . . 0.0 110.057 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -109.44 119.89 40.83 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.36 -178.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -96.63 -171.8 2.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.1 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . 0.459 HE21 ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -79.58 63.88 4.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.367 0.603 . . . . 0.0 110.085 177.786 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 168.76 -102.32 0.18 Allowed Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.339 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -95.75 178.11 5.56 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.875 0.369 . . . . 0.0 110.729 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 9.6 p -123.76 143.46 36.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.221 0.534 . . . . 0.0 111.659 -174.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . 0.768 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 41.1 m-85 -127.76 -172.84 2.77 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 174.57 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' HIS . . . . . 0.876 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 73.1 m80 -97.76 -164.53 1.15 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 172.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.6 pp -82.15 -23.57 35.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.895 0.379 . . . . 0.0 111.437 -178.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.56 -31.03 16.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.075 -175.343 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.876 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -78.79 -5.93 54.63 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.82 -176.342 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.33 76.6 1.86 Allowed 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.413 0.625 . . . . 0.0 110.5 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' THR . . . . . 0.729 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.7 OUTLIER -140.7 155.78 46.39 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.801 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' CYS . . . . . 0.507 ' HB2' ' N ' ' A' ' 119' ' ' ARG . 73.0 m -55.78 146.8 20.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.173 0.511 . . . . 0.0 111.369 175.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.73 -20.45 31.09 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.099 -179.586 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.3 -52.59 2.74 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.636 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 0.1 OUTLIER -94.56 -19.86 20.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.971 0.415 . . . . 0.0 111.08 -174.287 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.507 ' N ' ' HB2' ' A' ' 115' ' ' CYS . 4.9 mmt180 68.82 22.39 7.28 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.936 175.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ASN . . . . . 0.636 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 1.0 OUTLIER -63.9 130.23 43.26 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 171.725 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.729 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.6 OUTLIER -78.84 107.53 11.63 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.057 177.252 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.674 HD23 ' HA ' ' A' ' 128' ' ' PHE . 10.4 mt -63.99 139.73 58.8 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.441 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 3.0 t -121.86 132.36 24.25 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.436 -170.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' PRO . . . . . 0.692 ' HG3' ' HE3' ' A' ' 101' ' ' MET . 40.0 Cg_exo -55.42 110.72 0.59 Allowed 'Trans proline' 0 N--CA 1.461 -0.431 0 C-N-CA 122.59 2.193 . . . . 0.0 111.288 179.132 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 110.81 -16.29 28.4 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.583 -177.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.487 ' O ' ' HA ' ' A' ' 404' ' ' ILE . 3.3 t70 -116.61 -153.36 0.53 Allowed 'General case' 0 C--N 1.326 -0.423 0 O-C-N 122.665 -0.315 . . . . 0.0 110.641 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.405 ' HD3' ' OE2' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -74.64 139.54 43.65 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -171.221 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.674 ' HA ' HD23 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -157.74 144.94 18.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.929 -1.032 . . . . 0.0 108.618 170.955 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' HIS . . . . . 0.478 ' CD2' ' HD2' ' A' ' 141' ' ' ARG . 8.3 m-70 -137.35 120.57 16.81 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.425 178.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.454 ' HD1' HD22 ' A' ' 135' ' ' LEU . 11.0 t80 -115.68 101.14 8.57 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 175.008 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -126.71 126.57 68.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.553 -178.099 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.2 t30 58.5 25.72 13.4 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.166 -178.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 78.57 36.38 29.92 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.388 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' SER . . . . . 0.564 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 0.5 OUTLIER -139.55 150.48 45.12 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -179.014 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.454 HD22 ' HD1' ' A' ' 130' ' ' TYR . 43.5 mt -104.22 123.61 47.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.741 0.305 . . . . 0.0 111.489 -174.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 0.564 ' CE2' ' HB2' ' A' ' 134' ' ' SER . 39.5 m-85 -138.17 178.52 7.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.383 -0.826 . . . . 0.0 108.863 176.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 28.4 p -130.78 -153.18 0.55 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.008 0.432 . . . . 0.0 109.953 174.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.405 ' OE2' ' HD3' ' A' ' 127' ' ' ARG . 1.5 tt0 -77.7 -27.29 50.68 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.458 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -84.17 -53.21 5.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.072 -171.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.55 ' CG ' ' HB3' ' A' ' 118' ' ' CYS . 3.4 p-10 -96.07 31.17 2.21 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.692 0.758 . . . . 0.0 110.741 -178.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . 0.482 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 0.4 OUTLIER -62.29 126.3 87.54 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.855 179.828 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 3.0 Cg_exo -73.93 124.94 9.52 Favored 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.993 2.462 . . . . 0.0 112.205 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.34 53.13 2.69 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.353 0.597 . . . . 0.0 110.905 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -150.43 -77.04 0.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.233 -179.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.69 91.25 7.91 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.769 177.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 12.5 tt . . . . . 0 C--N 1.322 -0.599 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.47 -178.663 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.619 0 CA-C-O 120.701 0.056 . . . . 0.0 113.14 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 208' ' ' SER . . . . . 0.606 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 4.9 m -107.46 129.6 54.93 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 171.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 404' ' ' ILE . . . . . 0.487 ' HA ' ' O ' ' A' ' 126' ' ' ASP . 50.8 mm -109.81 129.85 63.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.787 -172.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 405' ' ' ALA . . . . . 0.45 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -64.69 134.14 95.93 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.969 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 406' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 5.6 Cg_exo -73.88 -176.48 2.62 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 123.011 2.474 . . . . 0.0 112.053 179.333 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -107.09 155.54 39.07 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.867 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -53.12 134.66 57.06 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.813 2.342 . . . . 0.0 112.846 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.19 175.71 9.33 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.162 -178.155 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -91.23 134.15 34.8 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.051 178.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 411' ' ' ALA . . . . . 0.454 ' HB1' ' CG2' ' A' ' 100' ' ' VAL . . . -83.51 178.73 7.88 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.417 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.9 tp -72.45 120.57 81.27 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 174.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -55.11 121.41 9.86 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.663 2.242 . . . . 0.0 112.06 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 414' ' ' THR . . . . . 0.54 HG22 ' HB3' ' A' ' 93' ' ' SER . 0.2 OUTLIER -82.34 162.17 22.31 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.546 179.821 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 415' ' ' SER . . . . . 0.512 ' HA ' ' HA3' ' A' ' 82' ' ' GLY . 24.2 m . . . . . 0 CA--C 1.529 0.169 0 O-C-N 123.753 0.658 . . . . 0.0 110.058 -174.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.946 0 N-CA-C 112.088 -0.405 . . . . 0.0 112.088 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.66 -26.94 4.43 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.787 0.327 . . . . 0.0 111.342 -176.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -80.83 -14.18 58.28 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.026 0.441 . . . . 0.0 111.372 -174.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.45 104.96 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.39 0.614 . . . . 0.0 111.593 -175.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.743 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 9.3 ptt-85 -124.53 4.29 8.31 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.691 175.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.974 HD12 ' HA ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -94.5 46.73 1.15 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.535 -171.527 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 51.0 35.35 12.52 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 121.498 0.666 . . . . 0.0 110.874 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 121.38 -129.2 7.64 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 -173.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.974 ' HA ' HD12 ' A' ' 80' ' ' LEU . 64.6 t30 -142.74 79.84 1.67 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.128 0.49 . . . . 0.0 111.462 175.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.29 -55.48 2.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.947 174.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 177.79 144.35 5.42 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.822 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.952 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -160.51 158.79 29.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.642 0.221 . . . . 0.0 110.836 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.804 ' HB2' ' HA ' ' A' ' 108' ' ' TYR . 0.1 OUTLIER -86.83 145.76 26.48 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.982 178.474 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.2 -12.54 60.91 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.088 -0.383 . . . . 0.0 111.714 -178.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -82.86 -47.87 11.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.586 0.231 . . . . 0.0 110.718 -177.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 2.6 p -126.84 -42.87 1.73 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.753 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.743 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 75.19 15.74 80.97 Favored Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.842 -0.617 . . . . 0.0 113.682 179.158 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.3 76.0 8.25 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 117.184 0.492 . . . . 0.0 111.687 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.665 ' HA ' HG22 ' A' ' 414' ' ' THR . 0.7 OUTLIER 62.43 128.67 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 O-C-N 124.228 0.955 . . . . 0.0 113.458 172.765 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.583 HG21 HG11 ' A' ' 100' ' ' VAL . 1.3 mt -103.82 99.51 16.46 Favored Pre-proline 0 C--N 1.32 -0.69 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 170.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.45 ' HD3' ' O ' ' A' ' 93' ' ' SER . 5.4 Cg_exo -78.54 159.17 28.84 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.175 2.583 . . . . 0.0 112.103 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.95 -16.89 56.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.372 0.606 . . . . 0.0 109.674 174.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.1 -35.25 31.9 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.965 -178.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.4 ' CD ' ' HZ1' ' A' ' 111' ' ' LYS . 4.6 mt-10 -100.74 118.45 36.86 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.9 mt -68.78 139.4 55.28 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.66 -179.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.583 HG11 HG21 ' A' ' 94' ' ' ILE . 2.7 m -117.74 148.75 20.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.284 0.564 . . . . 0.0 111.38 -176.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.437 ' HE1' ' CD2' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -89.7 115.85 27.38 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.994 -177.302 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 18.6 ptt180 -112.04 135.46 52.65 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.333 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -113.67 -122.59 0.29 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.201 -177.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.23 -54.13 48.04 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.071 0.462 . . . . 0.0 111.506 -176.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -162.1 31.83 0.32 Allowed Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -140.56 158.77 43.5 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -177.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -120.53 139.76 46.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.691 -176.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . 0.804 ' HA ' ' HB2' ' A' ' 87' ' ' CYS . 74.5 m-85 -137.46 160.34 39.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.36 178.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.778 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 29.0 m80 -85.84 152.2 23.19 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.5 pp -65.86 -21.17 66.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.0 0.428 . . . . 0.0 111.045 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.525 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.86 -23.47 21.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.196 0.522 . . . . 0.0 110.335 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.778 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 12.4 m -94.2 -2.3 52.73 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.331 -178.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . 0.588 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.0 OUTLIER -76.62 74.75 3.31 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.229 0.538 . . . . 0.0 110.33 177.127 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.579 HG23 ' HA ' ' A' ' 121' ' ' ARG . 2.2 p -130.6 154.26 48.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.06 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.54 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 17.0 p -72.56 150.91 42.73 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.099 0.476 . . . . 0.0 110.273 177.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.05 2.0 52.92 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.478 -177.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.62 -50.78 3.34 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -176.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.64 -2.78 10.92 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.841 0.353 . . . . 0.0 110.93 -177.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 62.24 41.15 10.78 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.782 -179.383 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . 0.575 HD21 ' HB2' ' A' ' 137' ' ' CYS . 10.7 t30 -89.44 128.78 35.99 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.579 ' HA ' HG23 ' A' ' 114' ' ' THR . 0.0 OUTLIER -72.45 126.76 30.63 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.826 0.345 . . . . 0.0 110.316 -177.894 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.469 HD23 ' HB2' ' A' ' 128' ' ' PHE . 0.7 OUTLIER -80.86 132.88 35.5 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.564 179.625 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.535 HG12 ' HD2' ' A' ' 124' ' ' PRO . 0.5 OUTLIER -127.24 139.28 34.7 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.789 -173.094 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.535 ' HD2' HG12 ' A' ' 123' ' ' VAL . 32.4 Cg_exo -58.98 110.93 0.75 Allowed 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.213 1.942 . . . . 0.0 110.612 171.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 112.65 -5.83 26.16 Favored Glycine 0 N--CA 1.447 -0.586 0 N-CA-C 111.26 -0.736 . . . . 0.0 111.26 -174.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -117.52 165.7 13.24 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 176.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 2.0 mtm-85 -93.81 131.32 39.29 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.122 0.487 . . . . 0.0 111.348 -174.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.469 ' HB2' HD23 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -138.63 171.84 13.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.22 -179.386 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . 0.611 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 86.1 m-70 -131.94 133.77 44.9 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.786 0.327 . . . . 0.0 110.776 178.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.479 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 69.2 t80 -125.47 101.61 7.01 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 1.5 mt -129.83 128.92 65.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.432 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 63.93 18.28 11.09 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 123.515 0.509 . . . . 0.0 110.992 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.479 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 81.82 30.52 35.28 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.225 -176.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.47 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.9 OUTLIER -126.13 155.33 41.84 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 -176.894 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.2 mt -108.21 123.7 49.16 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.161 0.505 . . . . 0.0 111.286 -174.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.611 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 22.1 m-85 -129.71 174.9 9.27 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 174.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . 0.575 ' HB2' HD21 ' A' ' 120' ' ' ASN . 10.4 p -127.62 -175.82 3.58 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.457 0.646 . . . . 0.0 111.589 -174.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.476 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -72.77 -25.52 61.2 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.279 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 47.4 t60 -76.9 -39.2 51.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.769 -175.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.466 ' OD1' ' HB3' ' A' ' 136' ' ' PHE . 1.7 p30 -85.28 -58.77 2.55 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.364 178.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 55.27 72.29 1.09 Allowed Pre-proline 0 C--N 1.327 -0.397 0 C-N-CA 123.146 0.579 . . . . 0.0 111.971 174.019 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.0 99.51 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.39 2.06 . . . . 0.0 111.866 176.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' THR . . . . . 0.738 ' HA ' HG23 ' A' ' 146' ' ' ILE . 0.1 OUTLIER -92.56 -21.25 20.2 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.53 -171.943 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -68.32 -24.41 64.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.601 -178.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -141.25 60.23 1.51 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.062 0.458 . . . . 0.0 111.253 -178.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.738 HG23 ' HA ' ' A' ' 143' ' ' THR . 1.0 OUTLIER -126.82 102.12 8.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.592 0.711 . . . . 0.0 110.102 176.165 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -72.21 100.0 2.49 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.927 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 123.26 -4.84 9.53 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.599 -0.81 . . . . 0.0 111.944 -177.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . 0.519 ' HA3' HG22 ' A' ' 146' ' ' ILE . . . -73.47 65.36 1.7 Allowed Glycine 0 C--N 1.332 0.307 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 176.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' SER . . . . . 0.471 ' HB2' ' H ' ' A' ' 204' ' ' GLY . 1.2 m -95.5 -101.98 0.16 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.542 -0.329 . . . . 0.0 110.397 179.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . 0.471 ' H ' ' HB2' ' A' ' 203' ' ' SER . . . -86.76 54.91 4.64 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.502 -178.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 82.79 102.57 0.48 Allowed Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.603 -178.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.61 133.37 51.02 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 177.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -112.56 56.94 0.45 Allowed Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.684 -175.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.23 130.33 36.37 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.855 0.359 . . . . 0.0 110.755 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . 0.455 HD13 HG23 ' A' ' 404' ' ' ILE . 35.7 mm -120.15 137.47 53.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.912 -176.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . 0.486 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -61.82 133.57 93.77 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.479 -177.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . 0.588 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 15.2 Cg_exo -68.69 172.48 11.51 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.111 2.541 . . . . 0.0 112.401 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -97.1 158.1 33.87 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.144 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -88.91 128.63 1.97 Allowed 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.762 2.308 . . . . 0.0 112.976 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . 0.51 ' O ' HG22 ' A' ' 100' ' ' VAL . 1.2 mt-10 -130.73 163.03 28.16 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -77.29 127.98 33.54 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 122.088 -0.383 . . . . 0.0 110.371 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -105.75 -84.29 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.56 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.4 OUTLIER -131.53 144.27 52.69 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.046 -176.118 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 5.6 Cg_exo -79.38 147.04 19.98 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.886 2.391 . . . . 0.0 111.037 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 414' ' ' THR . . . . . 0.665 HG22 ' HA ' ' A' ' 93' ' ' SER . 0.2 OUTLIER -86.55 147.62 25.87 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.831 0.348 . . . . 0.0 111.2 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 12.5 m -74.83 136.68 41.57 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.68 177.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -123.78 103.51 34.13 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.629 -0.259 . . . . 0.0 110.576 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -71.02 106.65 1.93 Allowed 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 123.024 2.483 . . . . 0.0 112.38 -179.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.482 -0.771 . . . . 0.0 110.555 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.233 0 N-CA-C 112.159 -0.376 . . . . 0.0 112.159 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.21 89.51 2.53 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.937 0.399 . . . . 0.0 111.515 -177.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -143.22 26.75 1.63 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.204 0.526 . . . . 0.0 110.597 178.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 1.2 mt -83.68 76.84 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.298 0.57 . . . . 0.0 110.722 -176.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.497 ' HE ' ' HA2' ' A' ' 91' ' ' GLY . 19.9 ptt180 -132.72 19.21 4.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.613 176.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.448 ' HB3' ' HB3' ' A' ' 86' ' ' ALA . 0.9 OUTLIER -113.08 -174.72 2.51 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.89 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -77.73 -35.97 51.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.96 0.409 . . . . 0.0 110.921 -177.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -116.34 -129.53 4.41 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 177.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 18.6 p30 -147.01 22.56 1.22 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.211 0.529 . . . . 0.0 110.356 175.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.87 -58.78 3.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.115 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -170.16 146.78 10.16 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 111.519 -0.633 . . . . 0.0 111.519 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.448 ' HB3' ' HB3' ' A' ' 80' ' ' LEU . . . -129.06 141.83 51.09 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.771 0.319 . . . . 0.0 110.986 -177.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.699 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 41.9 t -62.38 145.84 52.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.137 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.41 -25.42 42.09 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.611 176.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -96.0 -47.95 5.89 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.139 -177.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 56.0 m -83.06 -62.66 1.54 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.254 0.55 . . . . 0.0 110.244 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.699 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 118.19 -19.39 10.92 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.426 -175.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -78.11 177.38 8.38 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.937 0.399 . . . . 0.0 110.922 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -84.76 173.82 10.38 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.699 -174.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.659 HG23 HG22 ' A' ' 100' ' ' VAL . 2.3 mp -110.38 110.36 58.08 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.862 177.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -78.22 161.49 29.09 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 123.106 2.538 . . . . 0.0 112.127 177.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.19 -16.65 57.68 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.209 0.528 . . . . 0.0 110.987 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -93.8 -21.41 19.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.163 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -101.04 108.61 20.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.216 0.531 . . . . 0.0 110.064 -179.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 14.2 mt -66.96 131.53 46.06 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.249 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.694 ' HB ' ' O ' ' A' ' 108' ' ' TYR . 17.3 m -117.36 166.95 11.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.995 -175.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.9 111.96 20.39 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.599 ' HB3' HG22 ' A' ' 107' ' ' VAL . 0.0 OUTLIER -110.7 139.84 45.61 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.627 -175.914 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -119.78 -165.11 1.13 Allowed 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.134 179.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.402 ' H ' ' HG3' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -86.01 87.19 7.38 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.909 0.385 . . . . 0.0 110.543 -178.397 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 140.82 -48.03 0.84 Allowed Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.47 176.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -142.59 175.73 9.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.599 0.237 . . . . 0.0 110.383 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.599 HG22 ' HB3' ' A' ' 102' ' ' ARG . 5.0 p -132.6 141.01 46.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.881 -176.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . 0.694 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 1.4 m-85 -120.18 -173.87 2.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.193 175.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.772 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 74.7 m80 -103.91 -157.67 0.62 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 177.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -86.53 -22.29 26.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.008 176.248 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.84 -36.02 15.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.611 -174.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.772 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.62 -17.72 59.02 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.531 -174.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.87 85.35 0.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.766 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.822 HG23 ' HA ' ' A' ' 121' ' ' ARG . 0.6 OUTLIER -143.09 158.44 43.6 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.653 -178.42 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.456 ' HB3' ' H ' ' A' ' 120' ' ' ASN . 42.2 t -62.1 149.76 40.35 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.878 0.37 . . . . 0.0 110.182 175.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 3.5 m -92.68 -14.09 28.54 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.092 0.472 . . . . 0.0 110.579 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.79 -49.6 4.31 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.032 -178.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.09 4.58 13.69 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -174.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 63.9 13.2 7.4 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.466 0.707 . . . . 0.0 112.708 175.062 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . 0.511 HD21 ' HB2' ' A' ' 137' ' ' CYS . 13.4 t30 -63.66 123.86 19.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.816 -178.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.822 ' HA ' HG23 ' A' ' 114' ' ' THR . 0.7 OUTLIER -73.31 116.31 13.71 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.982 0.42 . . . . 0.0 110.894 179.282 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.58 HD21 ' HB2' ' A' ' 128' ' ' PHE . 0.7 OUTLIER -75.04 154.51 37.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.126 -179.506 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.522 HG23 ' CB ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -142.54 146.76 40.03 Favored Pre-proline 0 C--N 1.327 -0.402 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.868 -170.015 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -68.06 111.83 2.56 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.823 2.348 . . . . 0.0 111.768 175.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 113.85 -9.36 23.44 Favored Glycine 0 N--CA 1.448 -0.528 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 -177.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.522 ' CB ' HG23 ' A' ' 123' ' ' VAL . 6.4 t70 -105.42 -145.12 0.38 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 173.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.526 ' HD2' ' OE2' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -133.53 146.7 51.29 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.029 0.442 . . . . 0.0 110.992 179.127 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.58 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -143.1 145.4 32.82 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.458 178.148 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -109.39 126.39 53.38 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.108 0.48 . . . . 0.0 110.518 -178.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.442 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 4.6 t80 -124.2 101.5 7.23 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.549 HD11 HG12 ' A' ' 146' ' ' ILE . 0.5 OUTLIER -122.46 115.56 46.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.253 -178.709 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 12.1 t30 59.65 42.64 16.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.753 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.442 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 67.52 35.83 87.35 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.792 177.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 14.9 m -133.5 135.89 44.73 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 122.606 -0.35 . . . . 0.0 110.121 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 20.6 mt -89.48 120.94 31.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.93 -177.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 -130.11 167.84 17.71 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.442 177.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . 0.511 ' HB2' HD21 ' A' ' 120' ' ' ASN . 4.5 p -132.47 -169.44 2.23 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.076 0.465 . . . . 0.0 111.35 -177.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.526 ' OE2' ' HD2' ' A' ' 127' ' ' ARG . 5.1 mm-40 -72.69 -31.01 64.72 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.572 -173.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -66.24 -43.72 85.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.36 -173.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.453 ' OD2' ' HD3' ' A' ' 142' ' ' PRO . 14.9 p-10 -91.38 -49.85 6.12 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.733 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 41.73 69.56 2.04 Favored Pre-proline 0 N--CA 1.47 0.563 0 O-C-N 123.641 0.588 . . . . 0.0 111.543 178.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.453 ' HD3' ' OD2' ' A' ' 140' ' ' ASP . 32.0 Cg_endo -62.55 92.67 0.14 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.134 2.556 . . . . 0.0 112.756 -174.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.98 6.87 5.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.728 -175.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -87.03 -12.0 48.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.915 172.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.62 -50.64 2.94 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.321 178.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.549 HG12 HD11 ' A' ' 131' ' ' ILE . 0.0 OUTLIER -81.42 129.67 37.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.274 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.66 93.05 0.49 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -173.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 81.07 -63.59 4.28 Favored Glycine 0 CA--C 1.52 0.369 0 CA-C-N 115.936 -0.575 . . . . 0.0 114.238 168.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 99.19 84.02 1.76 Allowed Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 -172.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -79.94 65.45 5.11 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.921 0.391 . . . . 0.0 111.648 -174.166 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 78.63 -70.34 2.7 Favored Glycine 0 C--N 1.331 0.263 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -116.62 129.3 8.35 Favored Glycine 0 N--CA 1.443 -0.893 0 N-CA-C 110.576 -1.01 . . . . 0.0 110.576 175.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 25.8 m -146.32 160.19 42.36 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.936 0.368 . . . . 0.0 110.537 -177.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 105.7 -166.21 14.18 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.309 178.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.5 172.13 13.15 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -178.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . 0.436 HD13 ' O ' ' A' ' 126' ' ' ASP . 26.5 mm -84.42 -76.03 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . 179.34 151.67 0.52 Allowed Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.616 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -68.92 -16.27 40.95 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.215 1.943 . . . . 0.0 110.649 172.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 74.15 145.8 0.11 Allowed Pre-proline 0 C--N 1.34 0.158 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.214 177.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.23 115.32 3.6 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.306 2.004 . . . . 0.0 111.76 177.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -134.4 175.08 9.84 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.689 -177.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -100.32 135.58 41.54 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . 0.418 ' HB3' ' H ' ' A' ' 412' ' ' LEU . . . -85.97 -102.99 0.06 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 175.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.458 ' HA ' HD22 ' A' ' 412' ' ' LEU . 17.2 mt -132.3 139.89 36.26 Favored Pre-proline 0 C--N 1.321 -0.655 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 174.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -53.75 133.46 54.32 Favored 'Trans proline' 0 C--O 1.236 0.388 0 C-N-CA 122.783 2.322 . . . . 0.0 112.218 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 5.7 m -58.33 141.39 51.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.518 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 415' ' ' SER . . . . . 0.429 ' O ' ' HD3' ' A' ' 417' ' ' PRO . 0.8 OUTLIER -72.83 76.26 1.14 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 171.944 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 76.9 t60 -82.94 109.56 17.68 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.265 -177.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . 0.429 ' HD3' ' O ' ' A' ' 415' ' ' SER . 99.0 Cg_endo -82.12 -28.29 2.04 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.561 2.174 . . . . 0.0 112.869 -177.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.853 -0.594 . . . . 0.0 111.337 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.654 0 N-CA-C 112.213 -0.355 . . . . 0.0 112.213 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.35 109.95 2.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.067 0.461 . . . . 0.0 111.869 -177.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -131.37 22.85 4.78 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.175 177.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.435 ' H ' HG13 ' A' ' 78' ' ' ILE . 0.1 OUTLIER -106.8 106.36 20.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.544 -177.542 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.628 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER -176.25 -26.57 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.637 177.136 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.608 ' HB3' ' HB1' ' A' ' 86' ' ' ALA . 0.4 OUTLIER -108.13 -178.97 3.76 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.035 -174.213 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -80.66 81.65 6.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.727 175.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 114.27 -134.56 11.83 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.774 -0.727 . . . . 0.0 111.315 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 53.1 p-10 -152.29 35.33 0.52 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.125 0.488 . . . . 0.0 110.822 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.489 ' H ' HD11 ' A' ' 80' ' ' LEU . 0.3 OUTLIER -106.62 -113.69 0.27 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.058 -179.613 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . 0.485 ' H ' ' HB2' ' A' ' 84' ' ' SER . . . -88.08 124.76 7.32 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.81 -176.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.608 ' HB1' ' HB3' ' A' ' 80' ' ' LEU . . . -140.16 160.53 39.75 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 177.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.842 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 42.2 t -78.55 145.17 34.98 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.432 0.634 . . . . 0.0 111.288 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.02 -11.51 50.19 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.935 177.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -107.58 -50.36 3.08 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.938 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 28.1 m -82.48 -54.36 5.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.449 0.643 . . . . 0.0 109.736 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.842 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 102.56 -10.37 56.13 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.153 -173.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.05 146.4 52.68 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 176.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.416 ' HB3' HD12 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -65.64 144.31 57.02 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.04 -179.592 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.404 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 5.7 mt -93.72 118.6 67.44 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.237 178.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 94' ' ' ILE . 3.0 Cg_exo -77.21 144.56 23.51 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.998 2.465 . . . . 0.0 112.181 178.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.4 ' HB3' ' HB3' ' A' ' 413' ' ' PRO . . . -77.42 -6.34 53.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.2 0.524 . . . . 0.0 110.604 178.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.41 16.98 25.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.676 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -131.98 162.84 29.73 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.121 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.457 ' HA ' HD23 ' A' ' 99' ' ' LEU . 6.3 mt -106.69 116.06 31.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.167 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.484 ' HB ' ' O ' ' A' ' 108' ' ' TYR . 4.5 m -119.37 150.82 21.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.156 -174.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.51 ' HE3' ' HD2' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -92.51 152.88 19.41 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.316 179.764 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.588 ' HB3' HG12 ' A' ' 107' ' ' VAL . 0.0 OUTLIER -153.9 159.78 41.89 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.855 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -122.4 -162.28 0.99 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.553 -178.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.72 12.08 2.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.163 -178.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -137.34 -81.3 0.1 OUTLIER Glycine 0 N--CA 1.442 -0.935 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.526 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -106.52 175.44 5.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.8 0.333 . . . . 0.0 111.754 -174.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.588 HG12 ' HB3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -108.31 149.83 11.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.126 -177.57 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . 0.484 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 32.2 m-85 -141.77 -168.72 2.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.254 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.765 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 74.6 m80 -110.58 -157.42 0.61 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 172.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -86.17 -23.17 26.63 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.907 0.384 . . . . 0.0 111.266 176.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.41 -36.99 15.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.791 -174.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.765 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -74.58 -13.06 60.61 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.234 -174.375 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . 0.51 ' HD2' ' HE3' ' A' ' 101' ' ' MET . 0.0 OUTLIER -79.23 64.2 4.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.33 0.586 . . . . 0.0 109.996 175.541 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.573 HG23 ' HA ' ' A' ' 121' ' ' ARG . 0.0 OUTLIER -125.17 154.88 40.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.483 -178.612 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 12.5 t -62.91 135.93 57.57 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.258 0.552 . . . . 0.0 110.68 176.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 2.4 m -81.88 -17.5 47.06 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.697 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.32 -51.34 4.63 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -176.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 14.6 p -114.14 -7.09 13.05 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.379 -174.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.41 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 76.76 13.01 2.32 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.001 176.662 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -63.68 118.36 8.16 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 174.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.573 ' HA ' HG23 ' A' ' 114' ' ' THR . 0.6 OUTLIER -66.01 122.68 17.93 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 177.374 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.502 HD22 ' HB2' ' A' ' 128' ' ' PHE . 11.4 mt -68.08 127.22 32.08 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.339 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.489 ' HB ' ' CB ' ' A' ' 126' ' ' ASP . 71.0 t -107.61 134.12 20.14 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -172.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -55.82 109.95 0.49 Allowed 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 122.032 1.821 . . . . 0.0 111.018 175.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.37 6.5 56.58 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.507 -175.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.489 ' CB ' ' HB ' ' A' ' 123' ' ' VAL . 27.3 t0 -121.89 173.94 7.19 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 122.643 -0.328 . . . . 0.0 110.566 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.55 ' HB2' ' HG3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -65.34 140.82 58.7 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.22 0.533 . . . . 0.0 112.335 -176.569 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.615 ' O ' ' HB2' ' A' ' 208' ' ' SER . 0.0 OUTLIER -156.64 170.26 22.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.404 -0.817 . . . . 0.0 108.844 177.516 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -146.16 137.48 24.66 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.692 0.282 . . . . 0.0 110.683 176.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -125.03 100.92 6.8 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 7.1 mm -120.13 104.35 15.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.147 -177.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.1 t30 56.54 55.83 6.13 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.545 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 63.9 33.08 86.28 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.36 -0.837 . . . . 0.0 113.243 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.415 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 1.2 m -131.84 132.83 44.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -178.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 38.2 mt -91.88 116.98 29.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.345 0.593 . . . . 0.0 111.107 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.415 ' CE2' ' HB2' ' A' ' 134' ' ' SER . 61.4 m-85 -128.18 -179.47 5.02 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.238 -0.892 . . . . 0.0 108.712 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . 0.704 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 10.3 p -129.25 -178.91 4.85 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.036 0.446 . . . . 0.0 110.659 176.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.55 ' HG3' ' HB2' ' A' ' 127' ' ' ARG . 1.4 mm-40 -79.13 -14.19 59.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.387 179.073 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . 0.704 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 71.2 t60 -70.97 -47.22 60.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.26 0.552 . . . . 0.0 109.643 -178.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.52 29.73 5.9 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.571 175.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.494 ' HD2' ' H ' ' A' ' 206' ' ' SER . 14.5 ttp180 -22.64 99.22 0.06 OUTLIER Pre-proline 0 N--CA 1.474 0.725 0 C-N-CA 125.812 1.645 . . . . 0.0 113.9 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -97.55 73.31 0.09 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.449 2.766 . . . . 0.0 112.989 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.41 169.98 8.43 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.142 -0.349 . . . . 0.0 111.247 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . 65.66 -84.21 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.484 0.714 . . . . 0.0 111.206 178.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -93.05 20.82 6.36 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 176.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 5.7 mt 53.49 39.81 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.738 -171.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -173.13 113.12 0.23 Allowed 'General case' 0 C--O 1.232 0.172 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.104 -178.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 76.4 77.76 0.74 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.779 -0.724 . . . . 0.0 113.027 178.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -63.3 121.94 25.68 Favored Glycine 0 N--CA 1.452 -0.295 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 174.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -40.1 -66.91 0.27 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.712 0.805 . . . . 0.0 111.948 -178.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . -119.4 -161.46 11.65 Favored Glycine 0 CA--C 1.504 -0.651 0 N-CA-C 110.065 -1.214 . . . . 0.0 110.065 172.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -67.07 87.48 0.14 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.446 -0.883 . . . . 0.0 111.324 175.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 206' ' ' SER . . . . . 0.494 ' H ' ' HD2' ' A' ' 141' ' ' ARG . 1.4 m -56.6 -39.42 73.55 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.904 0.383 . . . . 0.0 110.644 -174.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 82.85 110.06 0.48 Allowed Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.521 -0.763 . . . . 0.0 114.385 169.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 208' ' ' SER . . . . . 0.615 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 68.7 m -156.45 138.3 14.33 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 171.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 46.5 mm -118.89 137.08 54.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.539 0.209 . . . . 0.0 110.576 -174.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . 0.468 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -75.23 134.48 73.87 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.125 -178.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 14.7 Cg_exo -70.3 -178.67 2.67 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 123.482 2.788 . . . . 0.0 112.458 177.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -97.95 157.92 33.75 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.333 -177.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . 0.442 ' HB3' ' SD ' ' A' ' 101' ' ' MET . 97.1 Cg_endo -87.51 121.04 1.55 Allowed 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.719 2.279 . . . . 0.0 112.054 172.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.99 178.08 7.39 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.297 178.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -62.25 149.75 41.02 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.095 0.474 . . . . 0.0 111.458 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . 0.429 ' HB3' ' H ' ' A' ' 412' ' ' LEU . . . -136.32 -145.23 0.21 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.575 179.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.429 ' H ' ' HB3' ' A' ' 411' ' ' ALA . 4.4 tp -73.01 128.18 88.3 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.733 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . 0.4 ' HB3' ' HB3' ' A' ' 96' ' ' ALA . 9.9 Cg_exo -72.17 168.96 22.67 Favored 'Trans proline' 0 CA--C 1.532 0.4 0 C-N-CA 123.095 2.53 . . . . 0.0 113.668 -175.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 90.8 m -92.49 133.08 36.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.594 178.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 69.4 m 59.98 -102.69 0.14 Allowed 'General case' 0 CA--C 1.533 0.294 0 O-C-N 123.329 0.393 . . . . 0.0 111.255 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -125.23 133.74 25.12 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -76.87 55.36 4.89 Favored 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 122.766 2.311 . . . . 0.0 112.734 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . 0.462 ' HG3' ' H ' ' A' ' 418' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.882 0 CA-C-O 118.834 -0.603 . . . . 0.0 110.311 176.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.577 0 N-CA-C 111.897 -0.481 . . . . 0.0 111.897 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.0 m -134.75 169.44 17.33 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 -177.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -110.82 142.12 43.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.826 0.346 . . . . 0.0 111.025 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 30.8 mm -75.91 136.33 25.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.553 176.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.787 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 39.1 ttp180 -131.58 -42.55 1.04 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.481 0.657 . . . . 0.0 110.784 -176.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.459 ' H ' ' HG ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -82.15 127.02 32.72 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.348 178.13 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -66.83 105.17 1.51 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.473 ' O ' ' HB2' ' A' ' 83' ' ' ASN . . . 94.93 -94.26 1.73 Allowed Glycine 0 N--CA 1.442 -0.964 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 -172.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.473 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 5.0 t-20 170.24 167.48 0.06 Allowed 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 177.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.7 m 71.03 -60.94 0.5 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 172.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -79.69 71.86 2.64 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.37 -172.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -148.18 170.78 17.11 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 122.293 0.237 . . . . 0.0 110.381 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.81 145.78 30.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.999 0.428 . . . . 0.0 110.231 -179.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.37 -8.31 55.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.542 -172.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.582 ' CB ' ' HB3' ' A' ' 112' ' ' CYS . . . -88.65 -54.11 4.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.642 0.258 . . . . 0.0 111.453 -176.187 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 31.5 p -98.28 -39.84 8.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.063 0.459 . . . . 0.0 110.509 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.787 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 96.77 8.74 56.91 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-N 115.652 -0.703 . . . . 0.0 112.223 -178.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.516 ' HA ' HE21 ' A' ' 92' ' ' GLN . 1.1 tp60 -89.24 155.62 19.28 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.781 0.324 . . . . 0.0 110.321 177.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.51 ' HB3' ' HB ' ' A' ' 414' ' ' THR . 13.9 m -71.39 160.27 33.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.472 -174.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.479 HG23 HG11 ' A' ' 100' ' ' VAL . 23.3 mt -101.14 111.23 63.2 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.219 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.73 148.0 22.31 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 123.021 2.481 . . . . 0.0 111.3 172.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.94 -11.78 61.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.037 0.446 . . . . 0.0 111.594 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.85 1.0 57.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.26 0.552 . . . . 0.0 110.797 179.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.07 175.38 5.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.912 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.628 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 32.0 mt -124.11 133.17 53.67 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.694 0.283 . . . . 0.0 110.337 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.625 HG21 ' O ' ' A' ' 409' ' ' GLU . 0.0 OUTLIER -115.96 142.29 29.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.364 0.602 . . . . 0.0 110.6 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 5.1 mmt -85.56 113.98 22.22 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.788 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -99.44 121.93 41.83 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.203 -178.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -104.71 -83.34 0.5 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.769 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -123.64 60.2 1.1 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.24 0.543 . . . . 0.0 110.279 -179.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.65 -17.37 45.12 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.105 -179.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . 0.422 ' ND2' ' HH ' ' A' ' 130' ' ' TYR . 0.3 OUTLIER -92.38 157.94 16.34 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 177.605 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -131.81 144.01 38.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.994 0.426 . . . . 0.0 111.745 -175.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -138.7 165.96 25.61 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 175.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.824 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 30.6 m80 -87.44 168.92 12.68 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.482 178.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.456 HD23 ' HA ' ' A' ' 110' ' ' LEU . 0.4 OUTLIER -62.58 -31.22 72.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.247 0.546 . . . . 0.0 110.983 177.906 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.48 -20.78 23.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.905 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.824 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 35.3 m -91.27 -4.13 56.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.624 -174.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . 0.558 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.1 OUTLIER -85.16 91.83 8.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.952 0.406 . . . . 0.0 110.553 178.025 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -146.43 156.19 43.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.237 -177.288 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.535 ' HB2' ' HB3' ' A' ' 137' ' ' CYS . 0.0 OUTLIER -70.82 152.64 43.52 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 169.501 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 1.4 p -93.21 -22.01 19.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -174.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.2 -51.05 4.56 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -172.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.698 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -101.57 -8.69 21.65 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.525 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.4 OUTLIER 62.78 44.75 6.21 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.429 -179.772 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . 0.449 ' H ' ' HB3' ' A' ' 115' ' ' CYS . 44.3 t30 -80.44 118.55 22.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.597 176.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -69.58 108.04 3.66 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 177.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.458 ' H ' ' HG ' ' A' ' 122' ' ' LEU . 0.6 OUTLIER -70.8 129.06 38.11 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.688 -179.669 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.2 t -145.26 146.71 31.37 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.778 -173.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.79 111.69 0.76 Allowed 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.63 2.22 . . . . 0.0 111.635 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.22 -19.77 13.09 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.338 -0.705 . . . . 0.0 111.338 -176.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.451 ' CG ' ' H ' ' A' ' 127' ' ' ARG . 9.6 t70 -101.93 -152.82 0.44 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.451 ' H ' ' CG ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -121.56 155.19 35.55 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.765 0.317 . . . . 0.0 110.815 -174.2 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.541 ' CE2' ' HB2' ' A' ' 130' ' ' TYR . 0.2 OUTLIER -157.61 143.31 17.31 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.655 174.3 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . 0.496 ' HE2' ' CD ' ' A' ' 138' ' ' GLU . 51.7 m-70 -121.33 122.81 40.67 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.831 0.348 . . . . 0.0 110.078 178.288 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.541 ' HB2' ' CE2' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -119.82 101.77 8.11 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 178.813 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 1.5 mt -108.52 103.21 15.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.13 -178.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.1 t30 58.17 28.5 16.58 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.803 177.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.404 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 92.75 30.17 9.93 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.775 -179.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -125.9 126.63 44.72 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 176.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 14.6 mt -91.66 115.7 28.27 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -174.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -136.38 179.01 6.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.461 176.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . 0.64 ' SG ' ' HB2' ' A' ' 139' ' ' HIS . 1.1 p -137.84 179.19 6.57 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.719 0.295 . . . . 0.0 110.792 176.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.496 ' CD ' ' HE2' ' A' ' 129' ' ' HIS . 6.8 mm-40 -73.72 -16.07 61.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.284 -176.343 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . 0.64 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 0.2 OUTLIER -78.43 -11.07 59.93 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.698 0.285 . . . . 0.0 110.885 -176.644 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.698 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 10.4 p-10 -127.82 -47.37 1.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.225 177.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.77 ' HG2' HD13 ' A' ' 146' ' ' ILE . 0.0 OUTLIER 46.77 68.43 3.47 Favored Pre-proline 0 N--CA 1.47 0.569 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 172.89 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.444 ' HD3' ' OD2' ' A' ' 140' ' ' ASP . 66.1 Cg_endo -94.6 -172.99 0.29 Allowed 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 122.884 2.389 . . . . 0.0 112.837 178.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' THR . . . . . 0.46 ' C ' ' H ' ' A' ' 145' ' ' LEU . 5.8 m 75.26 121.83 0.04 OUTLIER 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.226 -176.525 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -75.5 39.95 0.17 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.148 0.499 . . . . 0.0 111.023 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.46 ' H ' ' C ' ' A' ' 143' ' ' THR . 1.9 mt -162.69 27.06 0.1 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.093 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.77 HD13 ' HG2' ' A' ' 141' ' ' ARG . 3.0 tt -78.88 -15.82 13.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.088 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 72.47 159.98 0.22 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.109 -0.951 . . . . 0.0 111.913 177.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.54 100.69 2.69 Favored Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.627 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -82.49 179.69 53.05 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.794 -0.717 . . . . 0.0 111.894 179.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -75.31 81.52 2.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.086 0.47 . . . . 0.0 110.947 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 66.61 -105.1 1.2 Allowed Glycine 0 N--CA 1.448 -0.518 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.293 179.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -118.35 28.88 6.65 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.927 -0.654 . . . . 0.0 111.771 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 2.5 m -137.58 65.77 1.48 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.193 0.52 . . . . 0.0 110.68 176.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -70.21 -42.13 67.47 Favored Glycine 0 N--CA 1.449 -0.465 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.897 176.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 40.6 m -155.52 136.16 13.42 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.941 0.4 . . . . 0.0 110.582 177.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . 0.445 HG22 HD11 ' A' ' 404' ' ' ILE . 15.0 mm -93.85 136.16 26.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.232 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . 0.471 ' HA ' ' CD1' ' A' ' 128' ' ' PHE . . . -60.72 143.0 91.41 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.311 -178.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . 0.558 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 71.9 Cg_endo -74.68 -164.35 0.22 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.723 2.282 . . . . 0.0 112.541 179.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -117.07 146.07 37.17 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.086 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . 0.628 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 74.1 Cg_endo -77.1 125.52 7.98 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 122.551 2.167 . . . . 0.0 112.267 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . 0.625 ' O ' HG21 ' A' ' 100' ' ' VAL . 2.3 mt-10 -130.33 152.75 49.4 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.55 178.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -77.1 110.68 11.96 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.085 0.469 . . . . 0.0 110.376 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -93.85 -135.52 0.18 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.074 -178.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.401 ' H ' ' HG ' ' A' ' 412' ' ' LEU . 0.1 OUTLIER -81.22 129.26 67.52 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 179.508 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -78.83 164.98 24.97 Favored 'Trans proline' 0 C--O 1.237 0.47 0 C-N-CA 122.654 2.236 . . . . 0.0 112.586 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 414' ' ' THR . . . . . 0.51 ' HB ' ' HB3' ' A' ' 93' ' ' SER . 4.1 t -75.55 164.7 26.07 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.972 179.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.2 m -70.29 134.77 48.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.635 177.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 37.6 m80 -69.15 126.93 93.12 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-O 120.878 0.37 . . . . 0.0 110.064 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.53 173.4 4.46 Favored 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 123.063 2.509 . . . . 0.0 113.995 -174.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . 0.432 ' HG3' ' H ' ' A' ' 418' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.03 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.949 -175.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.614 0 N-CA-C 112.228 -0.349 . . . . 0.0 112.228 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.8 m 56.97 59.41 3.48 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 122.805 0.442 . . . . 0.0 111.68 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -134.41 120.92 20.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.18 177.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -128.19 129.28 69.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.621 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.08 18.42 6.58 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.163 175.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.513 ' HB3' ' HA ' ' A' ' 83' ' ' ASN . 0.3 OUTLIER -162.58 158.23 23.11 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.096 -179.414 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -62.59 -63.77 1.12 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.082 178.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -96.85 9.46 65.99 Favored Glycine 0 C--O 1.229 -0.19 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.402 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.513 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 5.2 t-20 61.01 94.49 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.482 0.658 . . . . 0.0 111.958 -178.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -146.82 -146.15 0.19 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 177.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.54 108.78 2.67 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.457 -0.878 . . . . 0.0 111.97 176.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.466 ' HB3' HD12 ' A' ' 80' ' ' LEU . . . -110.52 150.57 28.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.815 0.341 . . . . 0.0 111.381 -176.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.416 ' SG ' ' HB1' ' A' ' 89' ' ' ALA . 0.0 OUTLIER -73.39 128.57 35.87 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 175.286 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.59 -5.39 47.54 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.638 -172.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.479 ' CB ' ' HB3' ' A' ' 112' ' ' CYS . . . -84.64 -46.93 11.02 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 121.039 -0.264 . . . . 0.0 110.738 -177.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.544 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 31.2 p -110.18 -74.65 0.64 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.192 -178.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.544 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 134.81 7.07 2.14 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 111.476 -0.649 . . . . 0.0 111.476 -176.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -73.88 131.45 41.5 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.059 0.457 . . . . 0.0 110.436 178.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.506 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 1.4 m -69.03 121.18 16.13 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.839 175.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.603 HG12 HG13 ' A' ' 100' ' ' VAL . 2.6 mp -74.89 113.52 25.51 Favored Pre-proline 0 C--N 1.326 -0.427 0 O-C-N 123.62 0.575 . . . . 0.0 112.287 -172.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.506 ' HD3' ' O ' ' A' ' 93' ' ' SER . 5.6 Cg_exo -80.56 167.49 18.93 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 123.407 2.738 . . . . 0.0 110.879 167.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.68 -1.47 24.93 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.056 0.455 . . . . 0.0 111.063 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.62 -29.09 22.82 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.071 178.258 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -85.97 173.89 9.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.502 -178.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.455 ' HB2' HD22 ' A' ' 110' ' ' LEU . 25.5 mt -125.73 128.77 48.28 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.592 -178.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.603 HG13 HG12 ' A' ' 94' ' ' ILE . 0.0 OUTLIER -126.08 147.74 30.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.99 179.414 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.468 ' HE3' ' HD2' ' A' ' 113' ' ' PHE . 1.9 mtt -105.14 155.55 18.91 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.44 177.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 93.0 mtm-85 -112.6 98.69 7.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.677 0.275 . . . . 0.0 110.331 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -79.95 -36.36 36.31 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.121 0.486 . . . . 0.0 110.42 178.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.415 ' HB2' ' H ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -152.63 -127.45 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.675 178.69 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.415 ' H ' ' HB2' ' A' ' 104' ' ' GLN . . . -78.08 -26.31 60.28 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.741 -0.742 . . . . 0.0 111.853 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -103.27 162.31 13.1 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.937 0.399 . . . . 0.0 110.297 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 2.4 m -103.39 160.56 4.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.423 -176.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -137.29 143.1 41.98 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.625 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 7.6 m80 -69.27 161.87 28.36 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.871 0.367 . . . . 0.0 111.581 -177.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.455 HD22 ' HB2' ' A' ' 99' ' ' LEU . 0.3 OUTLIER -67.34 -27.63 67.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.231 0.538 . . . . 0.0 109.99 173.226 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.6 -23.19 22.01 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.738 178.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.625 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 63.6 m -94.77 -18.71 21.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.379 -176.244 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . 0.468 ' HD2' ' HE3' ' A' ' 101' ' ' MET . 0.0 OUTLIER -67.5 82.75 0.16 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.578 0.704 . . . . 0.0 110.508 177.029 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.751 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.5 p -135.47 160.99 36.73 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.693 -178.015 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.436 ' SG ' ' N ' ' A' ' 119' ' ' ARG . 26.2 p -72.73 149.94 43.3 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.349 0.595 . . . . 0.0 111.078 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.77 -2.27 58.51 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.455 179.232 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.559 ' HB ' ' SG ' ' A' ' 118' ' ' CYS . 0.8 OUTLIER -90.41 -54.68 3.9 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.65 -177.884 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.667 ' SG ' ' HB2' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -123.75 -20.9 5.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.231 -172.481 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.436 ' N ' ' SG ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 81.02 50.97 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 123.812 0.845 . . . . 0.0 111.288 -179.289 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -97.32 151.65 19.69 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 169.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.751 ' HA ' HG22 ' A' ' 114' ' ' THR . 1.1 ttm180 -86.15 130.14 34.62 Favored 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.005 -176.297 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.486 HD12 ' HB2' ' A' ' 128' ' ' PHE . 16.0 mt -77.25 158.42 30.27 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 173.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -134.39 139.12 31.83 Favored Pre-proline 0 C--N 1.325 -0.476 0 C-N-CA 119.967 -0.693 . . . . 0.0 111.35 -169.046 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.406 ' HB3' ' HD3' ' A' ' 408' ' ' PRO . 11.7 Cg_endo -55.68 121.63 10.3 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 123.075 2.516 . . . . 0.0 111.874 177.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 91.0 -2.06 78.81 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.438 -0.887 . . . . 0.0 112.331 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -112.26 -179.2 3.61 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 177.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.805 ' HG2' HD13 ' A' ' 404' ' ' ILE . 1.3 mtt85 -88.78 149.14 23.57 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.417 0.627 . . . . 0.0 112.314 -171.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.486 ' HB2' HD12 ' A' ' 122' ' ' LEU . 0.6 OUTLIER -148.91 145.58 27.48 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 175.721 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . 0.523 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 60.8 m-70 -115.31 121.65 43.52 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.76 0.314 . . . . 0.0 110.915 -175.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.498 ' HD1' HD21 ' A' ' 135' ' ' LEU . 1.4 t80 -112.58 100.78 8.99 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 174.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.496 HD12 ' HB3' ' A' ' 129' ' ' HIS . 8.4 mt -124.04 124.01 67.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.198 -175.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 61.1 33.96 19.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.237 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 69.39 35.1 75.4 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.869 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.49 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.8 OUTLIER -131.67 154.24 49.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.798 0.299 . . . . 0.0 110.359 -178.046 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.498 HD21 ' HD1' ' A' ' 130' ' ' TYR . 13.2 mt -96.54 114.59 26.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.497 -177.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.523 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 30.9 m-85 -120.43 157.26 29.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.343 0.592 . . . . 0.0 110.414 179.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . 0.542 ' HB2' ' H ' ' A' ' 140' ' ' ASP . 0.5 OUTLIER -92.55 152.41 19.64 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.921 -175.233 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.425 ' OE1' ' HD2' ' A' ' 127' ' ' ARG . 16.8 tp10 -80.37 -24.83 39.5 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.731 0.776 . . . . 0.0 108.909 161.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -81.54 -52.55 7.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.931 -171.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.667 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -114.94 34.39 4.86 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -178.322 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.446 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 9.9 ttp-105 -48.4 129.38 13.23 Favored Pre-proline 0 N--CA 1.464 0.27 0 CA-C-N 114.323 -1.308 . . . . 0.0 112.511 -173.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 21.2 Cg_exo -66.03 141.4 63.92 Favored 'Trans proline' 0 C--O 1.235 0.358 0 C-N-CA 122.829 2.353 . . . . 0.0 112.086 178.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.11 -3.9 57.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.558 -179.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -97.55 -74.14 0.58 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.808 -176.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' A' ' 145' ' ' LEU . 0.0 OUTLIER -84.12 85.77 7.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.922 0.392 . . . . 0.0 111.08 -176.159 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -143.12 138.39 26.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.991 176.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -87.55 45.77 1.31 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.193 0.52 . . . . 0.0 110.558 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 106.13 147.07 14.51 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.285 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -118.67 41.13 2.09 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.679 -0.772 . . . . 0.0 111.815 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.43 31.37 0.74 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.084 0.468 . . . . 0.0 111.366 -178.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 80.34 -74.67 2.31 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.657 178.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -83.07 37.89 2.71 Favored Glycine 0 N--CA 1.453 -0.192 0 C-N-CA 121.218 -0.515 . . . . 0.0 113.446 -174.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.35 -20.29 21.23 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.978 0.418 . . . . 0.0 110.192 176.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -105.04 171.85 19.26 Favored Glycine 0 N--CA 1.446 -0.684 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.183 178.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.43 -176.15 2.91 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.137 0.494 . . . . 0.0 111.316 -176.185 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . 0.805 HD13 ' HG2' ' A' ' 127' ' ' ARG . 10.7 mm -111.38 135.54 50.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 176.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -59.5 113.21 6.53 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 177.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . 0.469 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 83.7 Cg_exo -45.64 -72.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.655 2.904 . . . . 0.0 112.819 -172.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . 0.469 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 1.1 t80 168.95 139.28 0.05 OUTLIER Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.147 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . 0.429 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 73.1 Cg_endo -85.87 107.13 0.9 Allowed 'Trans proline' 0 N--CA 1.446 -1.323 0 C-N-CA 122.22 1.947 . . . . 0.0 110.907 171.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -129.81 168.98 15.74 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.428 -175.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -77.22 111.12 12.51 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.203 177.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -89.2 -168.63 2.23 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.966 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.478 ' H ' ' HG ' ' A' ' 412' ' ' LEU . 0.1 OUTLIER -64.68 121.17 71.71 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.27 179.408 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -57.26 127.48 25.77 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.773 2.315 . . . . 0.0 111.815 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 34.0 p -85.3 161.13 19.65 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.567 -175.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.1 m 64.92 -149.06 0.26 Allowed 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.038 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -127.56 92.78 42.17 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -69.87 135.65 30.73 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.834 2.356 . . . . 0.0 112.356 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 418' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.26 -0.876 . . . . 0.0 109.757 178.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.481 0 N-CA-C 111.839 -0.504 . . . . 0.0 111.839 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.69 -173.99 3.59 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 62.54 44.97 6.55 Favored 'General case' 0 N--CA 1.463 0.205 0 O-C-N 123.517 0.511 . . . . 0.0 110.815 177.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.471 ' H ' HG13 ' A' ' 78' ' ' ILE . 0.0 OUTLIER -100.27 93.87 3.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.25 178.846 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 48.1 ttt85 -75.3 -22.17 57.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.939 -174.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.927 ' HG ' ' HB1' ' A' ' 86' ' ' ALA . 6.5 mp -83.97 10.76 9.07 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.586 -175.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.722 ' HB2' ' HG ' ' A' ' 93' ' ' SER . 0.3 OUTLIER 49.28 84.48 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.558 0 O-C-N 123.803 0.69 . . . . 0.0 111.805 177.039 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.08 -16.98 19.35 Favored Glycine 0 C--O 1.228 -0.253 0 C-N-CA 120.306 -0.95 . . . . 0.0 111.083 -174.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.665 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 1.8 t30 71.11 54.39 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 123.654 0.781 . . . . 0.0 111.3 175.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.68 -58.44 1.88 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.565 177.215 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -155.38 142.82 9.23 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.615 -0.803 . . . . 0.0 112.382 -178.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.927 ' HB1' ' HG ' ' A' ' 80' ' ' LEU . . . -154.24 171.11 19.74 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.53 ' HB2' ' HA ' ' A' ' 108' ' ' TYR . 0.1 OUTLIER -95.76 145.04 25.63 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.1 m -82.01 6.37 16.35 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -174.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.602 ' HB1' ' HB3' ' A' ' 112' ' ' CYS . . . -96.98 -59.59 1.76 Allowed 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.86 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.442 ' HB3' ' HZ3' ' A' ' 111' ' ' LYS . 19.8 p -92.72 -36.76 12.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.85 0.357 . . . . 0.0 110.108 178.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 98.04 -3.37 60.29 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.487 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.434 ' HB2' ' SG ' ' A' ' 90' ' ' CYS . 0.0 OUTLIER -81.18 159.14 24.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.937 0.398 . . . . 0.0 110.612 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.722 ' HG ' ' HB2' ' A' ' 81' ' ' PHE . 0.0 OUTLIER -67.24 164.82 17.45 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.651 -173.794 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.5 mt -113.83 99.83 50.97 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.807 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -77.04 159.68 33.79 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.589 2.193 . . . . 0.0 111.243 174.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -70.07 -10.07 57.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.132 0.491 . . . . 0.0 111.125 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.51 -13.32 52.21 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.002 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -117.25 147.78 42.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.977 -178.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.607 ' HB2' ' HB2' ' A' ' 408' ' ' PRO . 1.0 OUTLIER -108.43 141.6 40.05 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.857 -179.657 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -115.59 139.66 40.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.139 0.495 . . . . 0.0 111.125 -177.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.576 ' HE1' ' CD2' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -85.19 122.1 28.89 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.659 177.312 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.469 HH21 ' CD ' ' A' ' 409' ' ' GLU . 0.0 OUTLIER -113.75 142.16 46.39 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.219 -178.649 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -118.48 -76.54 0.57 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.531 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.414 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 0.2 OUTLIER -90.64 -93.64 0.13 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.145 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.414 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -120.16 0.16 13.01 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.4 175.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -103.07 163.67 12.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.746 0.307 . . . . 0.0 110.821 -177.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.2 m -134.91 148.12 29.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.329 -178.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . 0.53 ' HA ' ' HB2' ' A' ' 87' ' ' CYS . 6.1 m-85 -138.67 146.59 41.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.68 177.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.928 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 54.2 m80 -72.33 168.74 17.73 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.409 HD23 ' HG3' ' A' ' 408' ' ' PRO . 0.3 OUTLIER -63.02 -31.85 73.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.207 0.527 . . . . 0.0 110.939 178.887 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.465 ' HG3' ' SG ' ' A' ' 112' ' ' CYS . 3.4 pttp -89.35 0.65 56.66 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.05 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.928 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 4.6 m -117.41 -10.1 10.76 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.557 -176.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . 0.576 ' CD2' ' HE1' ' A' ' 101' ' ' MET . 0.1 OUTLIER -75.6 69.68 2.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.549 0.69 . . . . 0.0 110.251 176.517 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.706 HG23 ' HA ' ' A' ' 121' ' ' ARG . 19.7 p -138.71 153.45 48.51 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.152 -0.931 . . . . 0.0 109.425 -178.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.484 ' HB3' ' HA ' ' A' ' 136' ' ' PHE . 3.6 p -71.89 153.2 42.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.059 0.457 . . . . 0.0 110.673 179.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -84.15 -8.02 59.2 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.063 0.459 . . . . 0.0 110.727 178.036 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.16 -51.11 5.76 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.925 -178.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.61 -6.45 10.19 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.487 -177.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.453 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 61.78 35.86 16.51 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.063 0.459 . . . . 0.0 110.551 -179.272 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . 0.586 HD21 ' HB2' ' A' ' 137' ' ' CYS . 49.2 t30 -80.95 131.61 35.34 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.643 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.706 ' HA ' HG23 ' A' ' 114' ' ' THR . 1.1 tpp85 -72.65 115.42 11.9 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.97 -178.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.449 HD11 ' HD2' ' A' ' 128' ' ' PHE . 5.6 mt -74.97 139.62 43.09 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 177.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -131.28 133.23 24.29 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-O 120.704 0.287 . . . . 0.0 111.603 -169.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -60.9 113.23 1.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.481 2.12 . . . . 0.0 110.538 171.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 120.21 -22.59 8.4 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 110.748 -0.941 . . . . 0.0 110.748 -173.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.01 -175.46 2.69 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.408 ' HB3' ' HG2' ' A' ' 138' ' ' GLU . 8.7 ttm-85 -99.07 148.37 24.11 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.849 0.357 . . . . 0.0 111.159 -173.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.449 ' HD2' HD11 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -143.2 156.76 44.83 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.508 176.366 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . 0.551 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 4.6 m-70 -117.39 117.89 30.72 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.001 0.429 . . . . 0.0 110.517 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.453 ' HA ' ' O ' ' A' ' 134' ' ' SER . 16.3 t80 -118.75 101.67 8.26 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 176.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -124.62 113.75 37.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.574 -177.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 7.0 t30 56.67 41.07 28.87 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.226 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 75.04 33.48 54.65 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.748 -0.739 . . . . 0.0 113.019 177.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.453 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.6 OUTLIER -126.98 145.45 50.7 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.828 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.408 ' HA ' HD21 ' A' ' 135' ' ' LEU . 79.1 mt -101.35 124.46 47.07 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.339 0.399 . . . . 0.0 110.967 -176.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.551 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 76.4 m-85 -135.95 164.4 28.06 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.613 175.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . 0.586 ' HB2' HD21 ' A' ' 120' ' ' ASN . 30.9 p -113.55 -167.23 1.17 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.28 0.562 . . . . 0.0 111.844 -175.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.408 ' HG2' ' HB3' ' A' ' 127' ' ' ARG . 1.3 mt-10 -75.36 -30.08 60.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.261 176.147 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . 0.465 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 77.6 t60 -73.84 -30.87 62.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.113 177.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.523 ' HB3' ' HD3' ' A' ' 142' ' ' PRO . 0.9 OUTLIER -66.47 -80.89 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.095 175.182 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.579 HH21 ' HA2' ' A' ' 205' ' ' GLY . 0.0 OUTLIER 48.97 59.65 16.78 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.362 -177.919 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.523 ' HD3' ' HB3' ' A' ' 140' ' ' ASP . 37.6 Cg_endo -66.01 92.37 0.26 Allowed 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.849 2.366 . . . . 0.0 112.03 -175.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' THR . . . . . 0.426 ' HA ' HG12 ' A' ' 146' ' ' ILE . 0.2 OUTLIER -76.23 58.86 1.31 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.371 -178.529 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -125.68 -65.88 0.97 Allowed 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.469 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -115.73 43.06 2.17 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.076 0.465 . . . . 0.0 110.266 179.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.426 HG12 ' HA ' ' A' ' 143' ' ' THR . 0.1 OUTLIER -74.52 152.98 6.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.833 -179.799 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -81.02 77.25 7.94 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.022 0.439 . . . . 0.0 111.056 -177.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 96.14 -61.6 1.31 Allowed Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.814 176.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 87.41 -102.3 2.77 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.36 -177.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 1.1 m 58.62 39.6 24.45 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.63 0.372 . . . . 0.0 111.795 174.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 118.54 -116.28 3.35 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.725 178.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . 0.579 ' HA2' HH21 ' A' ' 141' ' ' ARG . . . -90.92 67.68 2.37 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.767 -177.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.01 142.27 54.23 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.757 0.313 . . . . 0.0 111.048 177.35 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 121.65 127.44 3.38 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 121.002 -0.618 . . . . 0.0 111.634 -177.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.62 167.42 11.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.92 0.39 . . . . 0.0 110.686 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 46.9 mm -76.19 130.14 36.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -56.67 130.77 77.71 Favored Pre-proline 0 C--N 1.33 -0.247 0 O-C-N 123.337 0.398 . . . . 0.0 111.346 -177.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.78 162.07 30.01 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.851 2.368 . . . . 0.0 112.169 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -88.45 152.69 50.05 Favored Pre-proline 0 C--N 1.319 -0.758 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.043 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . 0.607 ' HB2' ' HB2' ' A' ' 99' ' ' LEU . 51.2 Cg_endo -70.27 126.62 13.17 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 122.161 1.907 . . . . 0.0 111.758 176.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . 0.469 ' CD ' HH21 ' A' ' 102' ' ' ARG . 2.6 mt-10 -127.0 160.7 30.32 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.465 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -79.5 123.52 27.64 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.651 -0.499 . . . . 0.0 109.651 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -103.38 -106.3 0.28 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.22 -177.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.78 117.23 37.8 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.42 131.94 26.07 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.578 2.186 . . . . 0.0 112.773 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 414' ' ' THR . . . . . 0.47 HG21 ' N ' ' A' ' 415' ' ' SER . 19.2 m -56.36 142.0 39.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.045 -0.98 . . . . 0.0 111.084 174.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 415' ' ' SER . . . . . 0.47 ' N ' HG21 ' A' ' 414' ' ' THR . 11.1 m -98.38 155.23 17.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.107 -176.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . 0.429 ' HA ' ' HD3' ' A' ' 417' ' ' PRO . 59.7 m80 -70.36 142.89 89.98 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.165 -0.47 . . . . 0.0 109.929 176.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 416' ' ' HIS . 3.5 Cg_exo -74.3 72.88 4.04 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 123.259 2.639 . . . . 0.0 112.644 -176.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.383 -0.818 . . . . 0.0 110.103 177.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.662 0 N-CA-C 111.475 -0.65 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -58.01 3.29 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.751 0.31 . . . . 0.0 111.427 -178.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -141.38 171.96 13.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.864 0.364 . . . . 0.0 111.047 -177.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 5.0 mt -87.61 107.5 17.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.32 -177.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.8 mtp85 -131.38 8.95 4.69 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.954 175.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.821 ' HB3' ' HB3' ' A' ' 86' ' ' ALA . 1.4 pt? -121.01 -179.43 4.02 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.494 -169.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.491 ' O ' HG21 ' A' ' 414' ' ' THR . 77.3 m-85 -105.81 141.81 36.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.224 175.112 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.64 -40.95 2.99 Favored Glycine 0 CA--C 1.517 0.2 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.616 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.482 ' HA ' HD23 ' A' ' 80' ' ' LEU . 2.3 t-20 81.75 33.76 0.1 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.637 0.775 . . . . 0.0 112.198 175.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.401 ' N ' HD11 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -130.25 66.99 1.48 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.282 177.032 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 117.65 98.18 1.95 Allowed Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.459 -0.877 . . . . 0.0 113.093 175.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.821 ' HB3' ' HB3' ' A' ' 80' ' ' LEU . . . -138.33 156.47 47.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.144 0.497 . . . . 0.0 110.838 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 4.6 t -70.4 146.57 50.31 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.392 178.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.94 8.54 39.36 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.525 172.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -120.94 -59.62 1.72 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.453 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.487 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 30.3 p -93.09 -77.61 0.44 Allowed 'General case' 0 C--O 1.233 0.207 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.541 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.487 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 145.84 -3.03 1.08 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.642 -0.789 . . . . 0.0 113.142 176.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.9 tp60 -63.89 128.39 35.59 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 117.275 0.538 . . . . 0.0 110.616 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.429 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 0.7 OUTLIER -56.34 120.79 8.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.804 -0.634 . . . . 0.0 109.54 172.389 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.479 HD12 HG12 ' A' ' 100' ' ' VAL . 5.1 mt -75.89 113.39 26.83 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 112.224 0.454 . . . . 0.0 112.224 -172.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.677 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 5.7 Cg_exo -78.19 167.68 22.9 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.373 2.715 . . . . 0.0 111.083 172.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.19 -2.87 26.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.86 0.362 . . . . 0.0 111.16 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.93 8.38 34.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.954 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.677 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 1.6 mm-40 -119.03 134.54 55.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.885 177.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.518 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 1.4 mt -100.82 136.63 40.37 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.061 0.458 . . . . 0.0 110.342 -178.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.479 HG12 HD12 ' A' ' 94' ' ' ILE . 1.6 m -115.37 136.5 51.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.718 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.466 ' SD ' ' HG3' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -84.26 123.42 30.12 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.068 -179.446 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 13.2 ptt85 -90.24 121.46 32.28 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.103 -177.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -105.13 -27.35 11.65 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.922 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -179.41 -128.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.811 -178.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -78.33 -8.29 87.57 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.567 -0.825 . . . . 0.0 111.252 173.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 28.5 m-20 -102.93 142.05 34.7 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 177.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -126.49 141.54 45.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.005 0.431 . . . . 0.0 110.896 -177.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -129.29 172.77 11.15 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 177.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.79 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 13.9 m80 -85.17 170.73 12.59 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 177.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.425 HD13 ' HD3' ' A' ' 111' ' ' LYS . 0.3 OUTLIER -69.63 -23.54 63.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.32 0.581 . . . . 0.0 109.521 173.578 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.46 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.25 -18.75 25.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.409 176.469 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.79 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 55.6 m -100.78 7.39 43.81 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.241 0.543 . . . . 0.0 111.06 -176.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . 0.443 ' HD1' ' HA ' ' A' ' 113' ' ' PHE . 0.1 OUTLIER -89.69 73.06 7.68 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.3 0.571 . . . . 0.0 110.273 177.84 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.782 HG22 ' HA ' ' A' ' 121' ' ' ARG . 15.2 p -133.48 155.7 49.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.145 -179.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 26.8 p -73.21 153.49 40.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.048 0.451 . . . . 0.0 110.816 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.49 2.16 42.3 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.977 -176.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -109.05 -51.63 2.86 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -179.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.95 -10.5 13.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.899 0.381 . . . . 0.0 110.941 -177.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 58.84 35.53 24.28 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.201 -177.006 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -73.87 120.8 19.96 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 174.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.782 ' HA ' HG22 ' A' ' 114' ' ' THR . 3.6 ttm180 -66.83 124.91 24.25 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.986 0.422 . . . . 0.0 110.749 -178.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.741 HD22 ' HB2' ' A' ' 128' ' ' PHE . 1.7 mt -76.75 158.91 30.58 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.138 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.522 ' O ' ' HB3' ' A' ' 405' ' ' ALA . 71.9 t -126.51 132.12 24.19 Favored Pre-proline 0 C--N 1.327 -0.41 0 C-N-CA 121.096 -0.241 . . . . 0.0 110.415 -172.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.422 ' HG3' ' HE1' ' A' ' 101' ' ' MET . 32.1 Cg_exo -59.06 111.39 0.89 Allowed 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.705 2.27 . . . . 0.0 111.096 175.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 93.49 17.09 43.53 Favored Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 120.568 -0.825 . . . . 0.0 111.793 -177.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -133.8 -176.17 4.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.815 0.34 . . . . 0.0 111.031 176.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -75.35 127.12 32.43 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.439 -172.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.741 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -145.62 165.72 27.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 172.593 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . 0.511 ' HB3' ' HB2' ' A' ' 136' ' ' PHE . 0.6 OUTLIER -131.19 128.67 40.46 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.719 -0.613 . . . . 0.0 111.822 -178.194 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.462 ' HB2' ' CZ ' ' A' ' 128' ' ' PHE . 1.7 t80 -125.58 101.07 6.73 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.063 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.52 HD12 HG13 ' A' ' 146' ' ' ILE . 56.2 mt -110.22 103.81 16.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.192 -177.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.7 t30 53.64 38.91 29.38 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.686 0.617 . . . . 0.0 111.262 -178.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 85.63 21.46 53.64 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.65 -0.786 . . . . 0.0 113.297 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -113.76 134.06 54.99 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 117.201 0.501 . . . . 0.0 109.769 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 14.5 mt -88.64 115.25 26.03 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.937 0.399 . . . . 0.0 111.23 -176.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.511 ' HB2' ' HB3' ' A' ' 129' ' ' HIS . 63.9 m-85 -131.09 168.18 17.85 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.554 176.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . 0.577 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 24.9 p -113.78 -169.65 1.55 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.204 0.525 . . . . 0.0 110.854 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.65 -28.97 51.43 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.99 177.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -77.83 -28.28 50.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.493 0.663 . . . . 0.0 109.517 178.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.577 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.4 OUTLIER -67.18 -82.15 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.313 174.657 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 42.46 73.33 0.94 Allowed Pre-proline 0 C--O 1.237 0.438 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.964 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.542 ' O ' ' HB ' ' A' ' 146' ' ' ILE . 50.4 Cg_exo -55.41 100.91 0.08 OUTLIER 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.758 2.305 . . . . 0.0 111.711 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.61 56.49 3.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.825 -173.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -158.72 -78.1 0.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.558 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.51 ' HA ' HD22 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -89.01 71.73 8.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.436 0.636 . . . . 0.0 109.562 175.576 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.542 ' HB ' ' O ' ' A' ' 142' ' ' PRO . 11.5 tt -122.94 159.99 26.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.234 -176.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -80.46 -17.46 51.62 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.883 0.373 . . . . 0.0 110.48 177.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . 0.516 ' H ' HG12 ' A' ' 146' ' ' ILE . . . 168.02 126.35 0.84 Allowed Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.704 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . 0.41 ' O ' ' HB3' ' A' ' 206' ' ' SER . . . -91.0 -28.49 15.25 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.538 -0.839 . . . . 0.0 111.85 177.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.46 -52.61 2.03 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.97 0.414 . . . . 0.0 110.296 177.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . -79.15 105.0 2.18 Favored Glycine 0 N--CA 1.45 -0.39 0 N-CA-C 110.352 -1.099 . . . . 0.0 110.352 171.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 72.71 51.64 11.21 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 -170.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 206' ' ' SER . . . . . 0.41 ' HB3' ' O ' ' A' ' 202' ' ' GLY . 0.0 OUTLIER -64.34 -5.53 5.33 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -172.853 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 170.81 173.77 38.21 Favored Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 121.018 -0.611 . . . . 0.0 112.183 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -113.61 134.19 54.86 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.917 0.389 . . . . 0.0 110.2 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 38.5 mm -79.27 117.99 25.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 176.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . 0.522 ' HB3' ' O ' ' A' ' 123' ' ' VAL . . . -59.94 132.79 89.61 Favored Pre-proline 0 C--O 1.235 0.34 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.321 -175.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . 0.508 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 2.8 Cg_exo -76.65 -170.81 0.96 Allowed 'Trans proline' 0 N--CA 1.462 -0.364 0 C-N-CA 123.663 2.909 . . . . 0.0 112.414 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -104.73 158.36 32.16 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.269 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . 0.518 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 5.8 Cg_exo -77.62 141.4 19.65 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.778 2.318 . . . . 0.0 112.086 178.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.32 177.28 7.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.291 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -104.28 121.1 42.63 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 178.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -84.8 -102.94 0.05 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.219 -178.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -131.74 130.89 22.44 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -68.01 145.33 67.27 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.132 1.888 . . . . 0.0 111.658 176.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 414' ' ' THR . . . . . 0.491 HG21 ' O ' ' A' ' 81' ' ' PHE . 0.1 OUTLIER -76.19 178.1 6.68 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.055 -176.196 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.48 166.58 23.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.099 178.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 48.7 m-70 -95.67 120.29 63.65 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.825 -176.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -86.83 5.81 5.64 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.719 2.279 . . . . 0.0 111.866 176.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . 0.425 ' HZ3' ' HA ' ' A' ' 418' ' ' LYS . 2.2 tpmp? . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.168 -0.92 . . . . 0.0 110.555 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.837 0 N-CA-C 111.76 -0.536 . . . . 0.0 111.76 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.1 76.82 1.62 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.192 0.52 . . . . 0.0 111.236 -177.356 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -122.18 118.29 28.27 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 176.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -108.56 143.33 19.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.07 0.462 . . . . 0.0 110.905 -175.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.608 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER -85.77 74.66 10.18 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.807 177.147 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.689 HD21 ' HB ' ' A' ' 414' ' ' THR . 0.5 OUTLIER -144.76 -179.97 6.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.948 0.404 . . . . 0.0 111.281 -177.847 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -92.15 -60.56 1.82 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.219 177.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.521 ' HA3' ' HA ' ' A' ' 415' ' ' SER . . . -87.19 -1.89 83.82 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.185 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 60.92 93.42 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.342 0.591 . . . . 0.0 111.923 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.482 ' HB2' HG23 ' A' ' 414' ' ' THR . 0.6 OUTLIER -146.31 -76.78 0.19 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.475 178.733 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -148.1 127.05 2.48 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 110.519 -1.033 . . . . 0.0 110.519 177.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -118.69 164.47 15.31 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.851 0.358 . . . . 0.0 111.296 -175.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 27.9 t -63.79 144.3 57.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.237 177.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.54 -8.16 58.47 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.297 -178.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -111.37 -33.69 6.34 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.08 -0.248 . . . . 0.0 111.148 -178.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.432 ' SG ' ' NZ ' ' A' ' 111' ' ' LYS . 32.0 m -100.03 -79.2 0.5 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.552 0.691 . . . . 0.0 110.272 175.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.608 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 113.28 57.56 0.41 Allowed Glycine 0 N--CA 1.442 -0.958 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.767 -176.267 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -146.65 178.39 8.33 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 177.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.29 160.48 29.59 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.383 0.611 . . . . 0.0 111.326 -177.524 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.771 HG22 HG12 ' A' ' 100' ' ' VAL . 2.8 mp -118.65 100.3 51.17 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.542 177.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.616 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 6.4 Cg_exo -75.41 167.78 25.93 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 123.238 2.626 . . . . 0.0 112.029 176.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.84 -16.01 60.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.88 -177.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.07 -17.24 29.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.955 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.616 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 12.6 mp0 -100.42 147.82 25.43 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.338 -177.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.401 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 21.9 mt -103.97 141.72 35.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.031 0.443 . . . . 0.0 111.088 -176.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.771 HG12 HG22 ' A' ' 94' ' ' ILE . 0.9 OUTLIER -125.94 147.24 30.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.037 178.121 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.454 ' SD ' ' HA ' ' A' ' 110' ' ' LEU . 0.0 OUTLIER -97.94 112.59 24.46 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.007 0.432 . . . . 0.0 110.308 -179.215 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -82.51 113.12 20.03 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.472 -179.092 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -100.11 -45.51 5.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.675 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.45 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 4.9 mm-40 -154.76 -137.84 0.07 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.102 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.45 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -75.47 -9.59 84.54 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 120.951 -0.643 . . . . 0.0 112.293 179.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -105.24 160.58 14.98 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 176.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -118.66 139.4 46.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.209 0.528 . . . . 0.0 111.921 -174.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -131.48 168.32 17.84 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 174.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.817 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 73.9 m80 -94.53 -163.92 1.11 Allowed 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.454 ' HA ' ' SD ' ' A' ' 101' ' ' MET . 0.4 OUTLIER -84.03 -20.22 33.09 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.002 0.429 . . . . 0.0 110.977 177.153 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.467 ' HZ1' ' CB ' ' A' ' 112' ' ' CYS . 0.0 OUTLIER -89.79 -22.09 22.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.74 -175.263 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.817 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -94.45 -5.46 46.18 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.156 -173.548 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.63 74.54 4.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.358 0.599 . . . . 0.0 109.616 175.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.602 HG22 ' HG2' ' A' ' 121' ' ' ARG . 38.2 p -127.39 147.8 50.27 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.171 -179.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.537 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 7.6 p -71.38 146.58 48.66 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.17 0.509 . . . . 0.0 110.355 177.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.08 -1.79 57.25 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.378 -176.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.35 -51.25 3.69 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -175.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.62 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -119.52 -3.71 10.39 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 111.645 0.239 . . . . 0.0 111.645 -175.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 70.61 38.98 1.2 Allowed 'General case' 0 C--O 1.233 0.221 0 O-C-N 123.847 0.717 . . . . 0.0 110.6 179.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -78.91 128.29 33.11 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.917 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.602 ' HG2' HG22 ' A' ' 114' ' ' THR . 0.2 OUTLIER -78.64 109.08 12.52 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 178.468 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.438 HD21 ' HB2' ' A' ' 128' ' ' PHE . 6.4 mt -67.73 148.59 51.08 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.914 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -136.8 140.28 31.37 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.214 -170.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.702 ' HB3' ' HA ' ' A' ' 407' ' ' PHE . 13.5 Cg_endo -55.77 111.42 0.76 Allowed 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.943 2.428 . . . . 0.0 111.887 178.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 108.06 -15.47 36.65 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.311 -176.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -97.55 -179.24 4.4 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.791 ' HD3' ' HG3' ' A' ' 138' ' ' GLU . 0.1 OUTLIER -101.77 143.11 32.1 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.055 0.455 . . . . 0.0 111.462 -171.932 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.438 ' HB2' HD21 ' A' ' 122' ' ' LEU . 1.4 p90 -149.72 151.46 33.69 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.748 176.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . 0.601 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 59.9 m-70 -113.29 118.51 34.83 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.033 0.444 . . . . 0.0 110.88 -177.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.469 ' HA ' ' O ' ' A' ' 134' ' ' SER . 23.5 t80 -108.36 101.35 10.55 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.879 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.511 HG22 ' O ' ' A' ' 145' ' ' LEU . 2.6 mt -130.64 132.41 64.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.771 179.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 55.7 t30 55.38 35.76 25.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.407 0.622 . . . . 0.0 110.449 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.401 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 67.36 35.93 88.33 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.809 178.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.469 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 4.3 m -131.27 151.18 51.74 Favored 'General case' 0 CA--C 1.517 -0.318 0 O-C-N 122.677 -0.308 . . . . 0.0 110.294 -177.529 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.7 mt -101.94 121.32 41.91 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.714 -177.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.601 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 59.7 m-85 -126.51 172.27 10.36 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 175.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 8.9 p -125.24 177.49 6.1 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.727 0.298 . . . . 0.0 110.774 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.791 ' HG3' ' HD3' ' A' ' 127' ' ' ARG . 8.8 mm-40 -77.92 -13.52 59.86 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.013 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -78.14 -33.45 50.38 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.62 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 2.7 p30 -91.92 -48.08 6.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.279 176.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 141' ' ' ARG . 0.0 OUTLIER 43.64 88.23 0.1 Allowed Pre-proline 0 N--CA 1.466 0.331 0 C-N-CA 124.118 0.967 . . . . 0.0 112.993 175.313 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -72.25 72.8 2.77 Favored 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 122.971 2.447 . . . . 0.0 112.041 178.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.41 55.81 0.82 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.469 0.652 . . . . 0.0 111.789 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -147.87 -56.75 0.23 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 175.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.511 ' O ' HG22 ' A' ' 131' ' ' ILE . 0.2 OUTLIER -90.34 71.87 7.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.78 174.721 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -140.73 138.53 35.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.346 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -79.33 66.59 4.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.449 178.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 67.11 33.22 82.67 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 121.156 -0.545 . . . . 0.0 111.854 -177.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 82.12 98.5 0.46 Allowed Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 -176.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -49.42 117.26 2.1 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -174.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 82.34 -37.41 2.58 Favored Glycine 0 C--N 1.333 0.41 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.724 177.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 159.48 46.6 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 110.105 -1.198 . . . . 0.0 110.105 -178.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 16.9 m 60.54 45.69 10.35 Favored 'General case' 0 C--N 1.333 -0.137 0 O-C-N 124.297 0.645 . . . . 0.0 110.756 -174.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 140.43 101.61 0.48 Allowed Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.882 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.48 155.91 20.34 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . 0.414 ' HA ' HD11 ' A' ' 404' ' ' ILE . 47.7 mm -110.0 134.97 50.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.466 -178.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -68.98 121.81 82.93 Favored Pre-proline 0 C--N 1.328 -0.348 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 175.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -57.54 -90.99 0.0 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.125 2.55 . . . . 0.0 112.905 -175.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . 0.702 ' HA ' ' HB3' ' A' ' 124' ' ' PRO . 0.2 OUTLIER -171.78 150.9 2.68 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -178.833 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . 0.603 ' HD2' ' CD1' ' A' ' 407' ' ' PHE . 47.8 Cg_endo -72.7 111.25 3.2 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 121.761 1.64 . . . . 0.0 110.723 168.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -120.38 170.36 9.44 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.358 -173.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -92.1 109.96 21.32 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 176.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . 0.428 ' HB3' HG22 ' A' ' 100' ' ' VAL . . . -84.11 -94.09 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.216 -176.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -131.24 126.32 21.37 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.895 -177.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -62.99 125.03 15.04 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.613 2.209 . . . . 0.0 111.292 173.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 414' ' ' THR . . . . . 0.689 ' HB ' HD21 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -107.42 162.35 14.0 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.039 -176.06 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 415' ' ' SER . . . . . 0.521 ' HA ' ' HA3' ' A' ' 82' ' ' GLY . 14.1 m 63.77 -151.58 0.31 Allowed 'General case' 0 C--O 1.235 0.291 0 O-C-N 123.568 0.542 . . . . 0.0 110.686 -178.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . 0.406 ' HA ' ' HD3' ' A' ' 417' ' ' PRO . 2.7 m-70 -112.27 141.01 24.28 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 174.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 416' ' ' HIS . 34.2 Cg_exo -60.57 -47.79 12.89 Favored 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.876 2.384 . . . . 0.0 112.861 -177.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.448 -0.787 . . . . 0.0 110.518 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.868 0 N-CA-C 111.807 -0.517 . . . . 0.0 111.807 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 m -86.46 107.08 17.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.23 0.538 . . . . 0.0 110.322 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -80.09 -33.09 39.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.283 -177.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 1.5 tt -122.54 122.96 67.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 121.507 0.67 . . . . 0.0 111.923 -175.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -146.61 6.12 0.93 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.603 171.197 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.493 HD23 ' HB1' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -96.16 112.98 24.55 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.213 -173.094 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -61.05 -38.75 87.28 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.705 0.764 . . . . 0.0 109.179 175.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.405 ' C ' ' H ' ' A' ' 84' ' ' SER . . . -100.83 111.79 4.24 Favored Glycine 0 N--CA 1.441 -0.974 0 N-CA-C 109.855 -1.298 . . . . 0.0 109.855 168.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -71.68 12.72 0.33 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -170.051 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.565 ' HB2' ' HB3' ' A' ' 412' ' ' LEU . 0.1 OUTLIER -82.0 -37.12 27.07 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.604 0.24 . . . . 0.0 110.869 178.269 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 176.67 170.11 38.82 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.927 -0.654 . . . . 0.0 111.859 -177.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.493 ' HB1' HD23 ' A' ' 80' ' ' LEU . . . -162.45 171.36 17.23 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.946 0.373 . . . . 0.0 110.814 -178.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.519 ' HB2' ' CE1' ' A' ' 109' ' ' HIS . 42.1 t -73.16 145.86 46.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.911 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.13 -6.96 59.49 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.997 0.427 . . . . 0.0 110.505 175.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -113.04 -49.89 2.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.067 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 26.9 m -84.4 -28.08 27.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.049 0.452 . . . . 0.0 110.604 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.97 25.9 75.01 Favored Glycine 0 N--CA 1.451 -0.341 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.947 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -115.38 142.08 47.17 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.491 -0.188 . . . . 0.0 110.491 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.7 m -65.55 157.74 28.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.143 176.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.656 ' O ' ' HA ' ' A' ' 413' ' ' PRO . 3.4 mp -113.12 116.69 46.74 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.477 -172.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.442 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 6.2 Cg_exo -75.52 165.95 29.52 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.925 2.417 . . . . 0.0 111.192 171.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.72 -16.65 61.66 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.34 0.59 . . . . 0.0 110.505 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.18 -14.77 59.32 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.093 177.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.442 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -109.64 159.57 17.01 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.184 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.3 mt -120.97 146.8 46.29 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.511 0.672 . . . . 0.0 110.931 -176.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.557 HG21 ' HB3' ' A' ' 411' ' ' ALA . 13.9 m -119.76 179.28 2.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.96 -178.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.1 mmt -134.09 122.38 22.84 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 174.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.4 105.38 12.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.049 0.452 . . . . 0.0 110.973 -175.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -88.25 66.75 8.55 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.866 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 55.7 47.36 20.69 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.368 178.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 130.74 -59.63 0.69 Allowed Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.407 178.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -89.99 170.31 10.47 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.886 -0.185 . . . . 0.0 110.553 -178.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -127.33 134.01 66.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.515 0.674 . . . . 0.0 112.42 -174.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -116.79 179.13 4.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 169.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.874 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 72.8 m80 -94.99 -164.29 1.15 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 176.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.6 tp -79.16 -23.03 44.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.949 0.404 . . . . 0.0 110.9 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.445 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.35 -38.29 13.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.253 0.549 . . . . 0.0 111.35 -176.759 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.874 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.26 -17.66 59.37 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.388 -175.472 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -72.16 77.02 0.96 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.592 0.711 . . . . 0.0 110.327 176.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.78 HG23 ' HA ' ' A' ' 121' ' ' ARG . 0.9 OUTLIER -145.6 164.05 32.9 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.083 -177.224 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.496 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 19.9 p -77.97 152.56 33.08 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 120.25 -0.58 . . . . 0.0 109.858 176.036 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.9 5.61 50.72 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.236 0.541 . . . . 0.0 110.722 -179.127 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.1 -50.77 3.55 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.804 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.93 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -113.53 -13.06 12.82 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.701 0.286 . . . . 0.0 111.064 178.183 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.496 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 65.45 39.36 5.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.38 -177.602 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -86.44 133.16 33.79 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 176.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.78 ' HA ' HG23 ' A' ' 114' ' ' THR . 0.0 OUTLIER -70.32 109.77 4.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.33 -179.01 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.592 HD13 ' HB2' ' A' ' 128' ' ' PHE . 19.8 mt -63.9 149.95 46.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.415 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.542 ' HB ' ' CB ' ' A' ' 126' ' ' ASP . 21.6 t -110.23 130.75 22.52 Favored Pre-proline 0 C--N 1.321 -0.636 0 C-N-CA 120.314 -0.554 . . . . 0.0 110.962 -167.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.455 ' HB3' ' HA ' ' A' ' 407' ' ' PHE . 17.9 Cg_endo -58.93 111.5 0.91 Allowed 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.843 2.362 . . . . 0.0 111.046 174.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 92.6 13.75 56.44 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.23 -177.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.542 ' CB ' ' HB ' ' A' ' 123' ' ' VAL . 1.4 t70 -133.09 -172.93 3.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.599 0.238 . . . . 0.0 110.755 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.21 136.55 57.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.059 -0.518 . . . . 0.0 112.31 -174.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.592 ' HB2' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -157.13 144.97 19.1 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.359 -0.837 . . . . 0.0 108.852 172.85 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . 0.528 ' O ' ' HA ' ' A' ' 135' ' ' LEU . 66.0 m-70 -118.6 125.99 50.98 Favored 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.752 -178.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.463 ' HB2' ' CE2' ' A' ' 128' ' ' PHE . 83.7 t80 -125.4 101.3 6.88 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -128.84 120.45 52.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.343 -177.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.5 t30 59.92 32.75 21.34 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.135 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 74.63 33.29 56.14 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.671 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -133.99 131.76 39.32 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.528 ' HA ' ' O ' ' A' ' 129' ' ' HIS . 6.1 mp -98.93 133.98 42.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.501 -176.424 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.451 ' HA ' ' CB ' ' A' ' 115' ' ' CYS . 21.0 m-85 -136.85 166.03 24.58 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.544 178.012 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 16.4 p -109.27 -168.45 1.34 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.913 0.387 . . . . 0.0 110.839 178.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -77.64 -26.71 50.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.472 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -73.55 -42.31 61.85 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.563 -175.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.93 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 0.6 OUTLIER -101.19 -2.17 32.0 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.469 -176.59 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 32.0 ttt-85 -29.69 105.61 0.22 Allowed Pre-proline 0 N--CA 1.478 0.931 0 O-C-N 124.517 1.136 . . . . 0.0 113.336 -178.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -79.06 88.78 1.42 Allowed 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 123.242 2.628 . . . . 0.0 112.301 178.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.52 -30.67 61.12 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.485 -0.779 . . . . 0.0 112.708 -176.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -75.08 -15.77 60.6 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -175.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 145' ' ' LEU . 1.0 OUTLIER -91.87 -22.39 20.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.818 0.342 . . . . 0.0 111.222 -175.95 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.491 ' H ' HG13 ' A' ' 146' ' ' ILE . 0.1 OUTLIER -114.36 160.29 13.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.562 -177.639 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -85.47 62.57 7.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.437 0.637 . . . . 0.0 109.432 178.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 73.58 6.38 71.02 Favored Glycine 0 N--CA 1.452 -0.282 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.944 -176.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 72.28 -97.69 0.78 Allowed Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -175.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 58.6 p -125.65 11.7 7.92 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.203 0.525 . . . . 0.0 109.772 174.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 81.02 52.11 4.45 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 -174.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 143.14 -42.82 1.06 Allowed Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 111.289 -0.725 . . . . 0.0 111.289 -176.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -129.45 -152.23 0.51 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -135.45 -106.22 0.85 Allowed Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 111.066 -0.814 . . . . 0.0 111.066 176.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -116.2 169.52 9.22 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 173.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . 0.419 ' HA ' HD11 ' A' ' 404' ' ' ILE . 50.9 mm -114.44 126.13 71.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . 0.506 ' HB3' ' O ' ' A' ' 123' ' ' VAL . . . -66.87 134.87 94.09 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.909 -177.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 20.0 Cg_exo -67.01 -176.19 0.73 Allowed 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 123.082 2.521 . . . . 0.0 111.715 176.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . 0.455 ' HA ' ' HB3' ' A' ' 124' ' ' PRO . 27.6 m-85 -107.94 163.46 16.91 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.942 -179.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -54.35 116.78 3.3 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.551 2.167 . . . . 0.0 111.704 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.7 177.53 4.64 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.123 -176.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -116.6 121.81 42.79 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 174.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . 0.557 ' HB3' HG21 ' A' ' 100' ' ' VAL . . . -90.88 -141.35 0.17 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.875 0.369 . . . . 0.0 111.244 -176.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.565 ' HB3' ' HB2' ' A' ' 84' ' ' SER . 0.0 OUTLIER -90.96 113.25 57.49 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.136 -179.41 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . 0.656 ' HA ' ' O ' ' A' ' 94' ' ' ILE . 14.6 Cg_endo -57.77 151.04 58.59 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.997 2.465 . . . . 0.0 113.173 -178.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 3.2 m -71.17 129.82 39.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.265 -178.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.44 106.95 1.52 Allowed 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 174.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 417' ' ' PRO . 17.8 m170 -77.91 137.5 61.83 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.962 -175.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 416' ' ' HIS . 24.2 Cg_exo -63.93 143.28 84.96 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.203 2.602 . . . . 0.0 112.677 -177.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 16.1 tttm . . . . . 0 C--O 1.248 0.998 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.382 -179.511 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.682 0 N-CA-C 111.486 -0.646 . . . . 0.0 111.486 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -140.77 154.58 46.34 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 -179.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -62.49 -52.7 62.47 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.269 0.557 . . . . 0.0 109.674 177.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.492 ' O ' HG22 ' A' ' 78' ' ' ILE . 0.0 OUTLIER -91.89 122.79 43.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.302 176.212 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.71 -32.66 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.153 -0.931 . . . . 0.0 108.576 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.672 HD13 ' HA ' ' A' ' 83' ' ' ASN . 1.3 pt? -96.2 28.98 2.98 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.195 176.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.619 ' HB3' HG23 ' A' ' 414' ' ' THR . 0.3 OUTLIER 52.64 74.69 0.27 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.99 -179.76 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 92.56 -125.63 8.21 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.222 -173.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.672 ' HA ' HD13 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -162.02 66.78 0.25 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.234 0.54 . . . . 0.0 110.4 178.914 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.38 -72.47 0.7 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.046 178.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -141.7 142.87 12.34 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 121.186 -0.531 . . . . 0.0 111.916 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -137.67 158.86 43.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.969 0.414 . . . . 0.0 110.91 -178.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.493 ' HB2' ' CE1' ' A' ' 109' ' ' HIS . 38.0 t -85.89 144.92 27.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.349 177.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.32 -4.0 58.6 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.882 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -117.11 -47.59 2.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.488 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 57.0 m -82.6 -40.64 20.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.852 0.358 . . . . 0.0 111.276 -179.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 85.57 9.16 79.23 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 110.814 -0.915 . . . . 0.0 110.814 -172.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.471 ' NE2' ' H ' ' A' ' 93' ' ' SER . 0.0 OUTLIER -93.88 164.7 13.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.366 -0.417 . . . . 0.0 109.953 179.213 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.608 ' HG ' ' HB2' ' A' ' 81' ' ' PHE . 0.0 OUTLIER -82.03 171.28 14.57 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.059 0.457 . . . . 0.0 111.218 -179.831 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.683 HG22 HG12 ' A' ' 100' ' ' VAL . 2.6 mp -114.77 105.31 53.48 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.372 175.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -73.8 159.12 45.87 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.767 2.311 . . . . 0.0 112.076 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.91 -13.08 61.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.975 0.416 . . . . 0.0 111.118 -178.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.74 12.26 32.62 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.926 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -123.2 157.04 33.91 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.221 0.534 . . . . 0.0 110.718 -179.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.6 mt -114.68 130.03 56.76 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.314 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.683 HG12 HG22 ' A' ' 94' ' ' ILE . 13.2 m -129.66 168.06 23.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.773 -175.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -112.11 141.13 46.18 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.022 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.2 136.35 49.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.361 -178.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -150.97 121.83 7.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.684 -0.234 . . . . 0.0 110.998 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 70.2 -2.64 2.04 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.162 0.585 . . . . 0.0 111.733 176.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 115.83 -16.09 16.29 Favored Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -175.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -89.97 163.92 14.76 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -124.4 140.21 48.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.034 0.445 . . . . 0.0 111.669 -177.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . 0.545 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 98.2 m-85 -131.09 167.49 19.01 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.366 -0.833 . . . . 0.0 108.771 175.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.8 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 72.5 m80 -92.73 -159.14 0.65 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 176.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 5.0 mt -85.29 -22.0 28.75 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.994 0.426 . . . . 0.0 111.37 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.63 -35.61 14.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.939 0.4 . . . . 0.0 111.763 -176.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.8 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.5 -16.66 59.59 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.207 -175.678 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.66 64.53 6.41 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.397 177.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.833 HG21 ' HA ' ' A' ' 121' ' ' ARG . 0.6 OUTLIER -131.14 152.47 50.4 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.774 -179.67 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 5.0 t -64.23 132.21 49.63 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 175.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 3.4 m -82.27 2.47 31.83 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.548 -176.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -106.03 -49.38 3.39 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -176.157 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.532 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 28.2 p -112.04 -14.42 13.45 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.055 0.455 . . . . 0.0 110.654 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.469 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 73.8 23.81 2.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.287 -179.034 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . 0.532 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 3.2 m-80 -65.88 133.63 51.33 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 170.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.833 ' HA ' HG21 ' A' ' 114' ' ' THR . 10.7 tpp85 -75.29 119.55 19.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.243 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.5 HD21 ' HB2' ' A' ' 128' ' ' PHE . 23.6 mt -58.89 137.19 57.93 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.428 ' H ' HG21 ' A' ' 123' ' ' VAL . 0.1 OUTLIER -115.27 132.38 23.09 Favored Pre-proline 0 C--N 1.321 -0.641 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.309 -165.972 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.452 ' HB2' ' CE2' ' A' ' 407' ' ' PHE . 19.9 Cg_endo -60.63 111.7 1.12 Allowed 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.628 2.219 . . . . 0.0 110.992 175.314 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 110.29 -4.48 29.89 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.604 -0.807 . . . . 0.0 112.045 -178.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.412 ' O ' ' HA ' ' A' ' 404' ' ' ILE . 1.0 OUTLIER -124.45 -177.76 3.9 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 177.203 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.508 ' HD2' ' HG3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -90.5 149.71 22.09 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.385 0.612 . . . . 0.0 112.348 -172.176 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.5 ' HB2' HD21 ' A' ' 122' ' ' LEU . 5.8 p90 -144.91 147.19 32.47 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.946 -1.025 . . . . 0.0 108.577 172.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -112.73 113.75 26.0 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.12 0.486 . . . . 0.0 110.973 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.483 ' CE2' ' HA2' ' A' ' 133' ' ' GLY . 3.8 t80 -92.66 101.1 13.5 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 175.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 28.1 mm -112.56 115.06 48.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.937 -176.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.5 t30 54.41 35.72 23.79 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 123.657 0.598 . . . . 0.0 111.288 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.483 ' HA2' ' CE2' ' A' ' 130' ' ' TYR . . . 80.24 30.11 42.88 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.938 177.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.409 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 0.7 OUTLIER -133.92 146.64 50.7 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.733 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.1 mt -95.37 118.98 33.08 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.865 0.364 . . . . 0.0 110.848 -177.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.409 ' CE2' ' HB2' ' A' ' 134' ' ' SER . 69.0 m-85 -126.85 159.66 33.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.939 176.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . 0.535 ' SG ' ' HB2' ' A' ' 140' ' ' ASP . 14.4 p -101.02 169.91 8.63 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.442 -178.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.508 ' HG3' ' HD2' ' A' ' 127' ' ' ARG . 1.5 mm-40 -77.9 -17.7 56.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.267 0.556 . . . . 0.0 110.264 174.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -20.76 58.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.622 0.725 . . . . 0.0 109.222 179.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.535 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 0.4 OUTLIER -104.07 -67.86 0.88 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.995 178.567 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 52.51 89.66 0.1 OUTLIER Pre-proline 0 N--CA 1.466 0.355 0 C-N-CA 123.468 0.707 . . . . 0.0 112.376 178.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -58.19 99.42 0.1 OUTLIER 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.047 2.498 . . . . 0.0 112.405 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.83 -26.64 63.37 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.96 -176.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.69 -39.84 95.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.774 -177.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.2 mt -152.28 90.87 1.54 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.501 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.41 ' H ' HG13 ' A' ' 146' ' ' ILE . 0.1 OUTLIER -99.66 46.36 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.956 -179.869 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -76.24 95.17 3.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.078 0.466 . . . . 0.0 110.322 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 159.68 -37.91 0.47 Allowed Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 110.659 -0.977 . . . . 0.0 110.659 -179.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -107.29 150.15 16.75 Favored Glycine 0 N--CA 1.45 -0.428 0 N-CA-C 111.598 -0.601 . . . . 0.0 111.598 176.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.37 19.33 1.25 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 121.177 0.513 . . . . 0.0 110.943 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 125.3 -93.8 0.44 Allowed Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 111.073 -0.811 . . . . 0.0 111.073 -176.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -132.7 47.94 0.98 Allowed Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 110.761 -0.936 . . . . 0.0 110.761 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.97 -38.53 88.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.891 0.377 . . . . 0.0 110.903 -178.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 84.32 80.4 1.06 Allowed Glycine 0 N--CA 1.442 -0.952 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.73 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -76.01 118.05 18.36 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 173.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . 0.412 ' HA ' ' O ' ' A' ' 126' ' ' ASP . 30.2 mm -81.54 138.95 18.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.938 -174.338 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -57.9 128.72 81.22 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.391 176.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . 0.6 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 38.1 Cg_endo -66.98 -5.46 13.56 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.383 2.722 . . . . 0.0 113.93 -174.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . 0.6 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 21.0 m-85 78.06 156.59 0.14 Allowed Pre-proline 0 N--CA 1.468 0.434 0 O-C-N 124.011 0.819 . . . . 0.0 109.935 -178.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.95 128.56 10.06 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.42 2.08 . . . . 0.0 112.203 176.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -140.44 177.21 8.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.585 176.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -86.29 125.63 33.74 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.784 0.326 . . . . 0.0 110.871 -179.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -91.92 -143.03 0.19 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.165 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 13.3 mt -85.35 116.55 66.01 Favored Pre-proline 0 N--CA 1.452 -0.369 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 177.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.75 154.82 67.18 Favored 'Trans proline' 0 C--O 1.237 0.453 0 C-N-CA 122.818 2.346 . . . . 0.0 112.84 -178.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 414' ' ' THR . . . . . 0.619 HG23 ' HB3' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -69.25 154.61 41.76 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.259 179.775 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 5.9 m -69.7 138.55 52.99 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.174 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . 0.486 ' HA ' ' HD3' ' A' ' 417' ' ' PRO . 17.5 t60 -72.75 114.26 28.75 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.167 177.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . 0.486 ' HD3' ' HA ' ' A' ' 416' ' ' HIS . 2.8 Cg_endo -80.05 58.56 7.04 Favored 'Trans proline' 0 C--O 1.237 0.429 0 C-N-CA 123.247 2.631 . . . . 0.0 112.625 -175.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.079 0 CA-C-O 117.97 -1.014 . . . . 0.0 109.799 175.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.874 0 N-CA-C 111.866 -0.493 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.401 ' HB2' HG13 ' A' ' 78' ' ' ILE . 0.0 OUTLIER -131.26 140.76 49.89 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.299 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 7.8 p90 -71.79 -19.53 61.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.818 0.342 . . . . 0.0 111.21 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.401 HG13 ' HB2' ' A' ' 2' ' ' SER . 0.6 OUTLIER -79.42 100.3 3.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.148 0.499 . . . . 0.0 110.728 178.482 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.409 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -97.4 6.48 48.17 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.534 0.683 . . . . 0.0 110.015 179.693 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.776 HD13 ' HA ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -121.56 113.71 20.17 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.607 -172.627 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -61.2 -35.56 77.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.32 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -124.3 26.43 5.79 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.149 -0.548 . . . . 0.0 111.963 179.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.776 ' HA ' HD13 ' A' ' 80' ' ' LEU . 2.7 t-20 69.41 161.73 0.21 Allowed 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.509 0.724 . . . . 0.0 112.801 178.143 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 51.4 m 71.76 -61.15 0.5 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.008 -0.996 . . . . 0.0 113.46 174.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -89.23 122.2 6.36 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.547 -0.835 . . . . 0.0 113.22 -174.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.5 ' HA ' ' HA ' ' A' ' 93' ' ' SER . . . -168.29 133.42 1.76 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.578 0.228 . . . . 0.0 111.127 177.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.33 133.57 34.04 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 171.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.7 m -86.66 8.66 21.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.052 -0.522 . . . . 0.0 112.229 -172.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.653 ' HB2' ' HB3' ' A' ' 112' ' ' CYS . . . -98.17 -59.53 1.74 Allowed 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.082 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 26.1 p -86.42 -60.08 2.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.254 0.549 . . . . 0.0 110.609 -177.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.409 ' HA2' ' HE ' ' A' ' 79' ' ' ARG . . . 133.07 -2.8 4.79 Favored Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.739 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -82.19 122.24 27.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.902 0.382 . . . . 0.0 110.279 178.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.5 ' HA ' ' HA ' ' A' ' 86' ' ' ALA . 0.9 OUTLIER -63.13 128.03 33.96 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.809 172.833 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.422 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 1.7 mt -65.31 119.66 61.17 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.789 -174.266 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 94' ' ' ILE . 2.9 Cg_exo -76.88 166.9 26.17 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.25 2.633 . . . . 0.0 111.817 176.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.42 0.85 18.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.931 0.396 . . . . 0.0 111.499 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.18 21.39 14.22 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.875 179.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -135.88 160.31 38.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.739 179.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.1 mp -120.86 150.55 40.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.336 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.9 157.4 42.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.939 -178.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.0 126.78 52.6 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.078 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 10.1 mtt-85 -91.48 97.77 11.27 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.68 -59.07 4.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.752 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.3 91.12 0.37 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.004 179.163 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 82.09 -52.69 4.66 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.012 -0.613 . . . . 0.0 112.292 -176.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -90.97 158.66 16.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.586 0.231 . . . . 0.0 111.285 -178.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -118.09 144.24 26.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.9 0.381 . . . . 0.0 111.072 -177.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -137.0 163.74 30.01 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.672 177.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.772 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 12.4 m80 -79.49 170.82 16.01 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.824 0.345 . . . . 0.0 110.773 -179.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.38 -31.61 72.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.821 177.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.507 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.48 -30.83 18.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.122 0.487 . . . . 0.0 110.551 178.609 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.772 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 34.0 m -79.0 -13.74 59.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.148 -178.131 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -76.18 76.03 3.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.091 174.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.766 HG21 ' HA ' ' A' ' 121' ' ' ARG . 0.7 OUTLIER -133.79 149.7 51.42 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.115 -178.425 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.449 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 5.5 p -74.53 155.16 38.22 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.142 0.496 . . . . 0.0 111.174 -179.376 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 1.5 m -79.68 -45.68 18.53 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.248 -175.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.74 -51.57 39.93 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -171.222 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.79 -14.65 16.53 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 121.051 -0.259 . . . . 0.0 111.196 -175.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.449 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 69.41 31.65 3.74 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.88 -176.819 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -83.4 146.96 28.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.639 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.766 ' HA ' HG21 ' A' ' 114' ' ' THR . 9.0 ttt180 -85.84 135.47 33.7 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.879 0.371 . . . . 0.0 111.313 -175.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.0 mt -81.75 125.71 30.96 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 38.6 t -122.56 138.38 29.21 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.621 -170.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.43 111.41 0.93 Allowed 'Trans proline' 0 N--CA 1.463 -0.277 0 C-N-CA 122.406 2.07 . . . . 0.0 111.072 174.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 114.34 -21.36 15.06 Favored Glycine 0 N--CA 1.446 -0.641 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 -173.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.47 176.02 5.49 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.711 ' HB2' ' HB2' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -102.46 135.83 43.38 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.703 0.287 . . . . 0.0 111.363 -173.807 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -132.52 159.6 38.95 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.027 179.322 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 78.1 m-70 -130.09 140.58 50.8 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.774 0.321 . . . . 0.0 110.528 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.439 ' HD1' HD21 ' A' ' 135' ' ' LEU . 10.7 t80 -125.28 101.98 7.23 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 178.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.425 HD11 ' HB ' ' A' ' 146' ' ' ILE . 7.6 mt -121.84 111.33 30.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 120.732 0.301 . . . . 0.0 110.649 -176.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 51.7 t30 57.87 51.13 9.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.667 179.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.418 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 62.19 35.58 91.74 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.736 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 2.6 m -133.38 138.85 46.48 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -177.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.439 HD21 ' HD1' ' A' ' 130' ' ' TYR . 24.3 mt -92.67 125.34 37.25 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.975 -175.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.512 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 76.5 m-85 -129.43 161.96 29.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.055 176.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . 0.46 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 17.1 p -111.07 -176.14 2.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.953 0.406 . . . . 0.0 111.298 -175.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.711 ' HB2' ' HB2' ' A' ' 127' ' ' ARG . 0.0 OUTLIER -71.56 -32.94 68.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.871 176.661 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -68.11 -34.42 76.34 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 177.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.46 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.7 OUTLIER -66.35 -77.73 0.06 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.271 175.47 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 44.18 70.59 1.83 Allowed Pre-proline 0 CA--C 1.529 0.15 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.855 -176.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -72.09 78.66 1.81 Allowed 'Trans proline' 0 C--O 1.236 0.394 0 C-N-CA 122.762 2.308 . . . . 0.0 111.786 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 18.4 m -57.79 -41.2 81.63 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.993 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -71.62 -24.28 61.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.945 0.402 . . . . 0.0 111.45 -177.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -79.79 -52.66 7.64 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.1 -178.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.425 ' HB ' HD11 ' A' ' 131' ' ' ILE . 0.8 OUTLIER -90.73 -22.79 6.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.728 -175.526 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 59.41 48.25 10.16 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.345 0.593 . . . . 0.0 110.795 -176.692 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 168.1 -92.12 0.1 Allowed Glycine 0 N--CA 1.453 -0.227 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.443 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 146.06 63.37 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.54 -0.838 . . . . 0.0 112.933 177.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 1.1 m 39.68 63.24 1.05 Allowed 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 176.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 91.92 -88.35 1.35 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.485 -0.864 . . . . 0.0 112.939 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -111.28 49.55 0.84 Allowed Glycine 0 N--CA 1.454 -0.114 0 C-N-CA 120.74 -0.743 . . . . 0.0 113.503 -173.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 3.4 m 60.35 28.1 17.71 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.063 0.458 . . . . 0.0 112.034 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 133.72 101.66 0.75 Allowed Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.98 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.48 144.91 28.42 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.866 0.365 . . . . 0.0 110.811 -178.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 28.4 mm -79.43 141.74 14.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 177.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . 0.454 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -50.25 127.06 22.24 Favored Pre-proline 0 N--CA 1.462 0.128 0 O-C-N 123.289 0.368 . . . . 0.0 111.025 177.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 15.3 Cg_exo -69.45 10.29 0.46 Allowed 'Trans proline' 0 N--CA 1.475 0.44 0 C-N-CA 123.733 2.956 . . . . 0.0 114.023 -171.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . 0.4 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 15.1 m-85 70.34 158.54 0.16 Allowed Pre-proline 0 N--CA 1.466 0.355 0 O-C-N 123.554 0.534 . . . . 0.0 111.741 176.023 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -83.89 149.38 12.4 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.647 2.232 . . . . 0.0 112.915 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -155.13 160.74 41.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.441 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -78.19 124.59 28.25 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 176.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -94.45 -139.48 0.23 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.288 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.45 111.79 50.86 Favored Pre-proline 0 C--N 1.329 -0.286 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 175.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_exo -61.75 132.18 38.88 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.512 2.141 . . . . 0.0 112.16 -179.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -70.64 139.03 51.22 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.407 -179.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 415' ' ' SER . . . . . 0.407 ' O ' ' HD3' ' A' ' 417' ' ' PRO . 0.9 OUTLIER 71.73 152.99 0.12 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.777 0.831 . . . . 0.0 111.845 177.85 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 9.4 m170 -106.36 98.96 21.52 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.292 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . 0.407 ' HD3' ' O ' ' A' ' 415' ' ' SER . 19.2 Cg_endo -91.72 24.99 0.5 Allowed 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.521 2.814 . . . . 0.0 112.605 -176.269 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.845 0 CA-C-O 118.781 -0.628 . . . . 0.0 109.832 -179.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.672 0 N-CA-C 112.298 -0.321 . . . . 0.0 112.298 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 m 54.25 50.9 15.4 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.372 0.669 . . . . 0.0 111.939 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -87.64 -30.91 20.08 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.138 0.494 . . . . 0.0 109.976 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 7.9 tt -158.07 129.99 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.646 179.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.0 ttt85 -151.21 33.03 0.58 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.31 0.576 . . . . 0.0 109.793 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.675 HD23 ' HB1' ' A' ' 86' ' ' ALA . 0.4 OUTLIER -154.76 -176.72 6.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.116 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -82.26 72.04 9.32 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.54 0.686 . . . . 0.0 110.067 176.52 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 125.29 -117.65 3.03 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.413 -178.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -159.32 175.49 13.31 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 178.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 10.5 m 62.09 73.29 0.47 Allowed 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.88 0.737 . . . . 0.0 112.04 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . 0.668 ' HA3' HG21 ' A' ' 414' ' ' THR . . . 128.59 83.41 0.37 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.191 -1.004 . . . . 0.0 112.978 175.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.675 ' HB1' HD23 ' A' ' 80' ' ' LEU . . . -148.25 144.37 27.61 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.629 -0.336 . . . . 0.0 110.181 178.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 4.7 t -66.65 142.62 57.39 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.693 177.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.584 ' HB2' ' CE1' ' A' ' 108' ' ' TYR . 0.7 OUTLIER -95.13 8.37 43.21 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.677 174.637 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.671 ' HB1' ' HB3' ' A' ' 112' ' ' CYS . . . -118.42 -59.7 1.86 Allowed 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.622 -179.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.431 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 31.1 p -91.09 -73.97 0.52 Allowed 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.167 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.431 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 129.56 61.02 0.1 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.548 176.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.499 ' NE2' ' HA ' ' A' ' 92' ' ' GLN . 0.5 OUTLIER -137.52 150.51 47.58 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.6 0.238 . . . . 0.0 110.374 178.612 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.0 119.71 14.62 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.972 176.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.5 mp -76.54 120.23 80.79 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.785 -174.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 98' ' ' GLU . 5.7 Cg_exo -77.74 166.24 25.69 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.524 2.816 . . . . 0.0 111.778 173.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.23 -21.05 61.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.962 0.411 . . . . 0.0 110.982 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.42 -13.66 58.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.282 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.408 ' HB3' ' HD2' ' A' ' 95' ' ' PRO . 15.1 tt0 -106.38 121.08 43.53 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.038 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 21.2 mt -84.75 139.3 32.07 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.552 -178.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.42 ' O ' ' HA ' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -115.09 144.59 22.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.945 -178.229 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.57 ' HE1' ' HD3' ' A' ' 124' ' ' PRO . 0.0 OUTLIER -91.81 120.26 32.36 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.993 179.965 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -96.74 108.76 21.46 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.034 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -82.34 -40.22 21.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.055 0.455 . . . . 0.0 110.152 175.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.415 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -174.34 -106.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.582 176.747 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.415 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -76.69 -30.19 56.57 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.603 -0.808 . . . . 0.0 111.719 176.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -89.38 159.48 17.3 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.714 0.292 . . . . 0.0 110.974 -176.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -128.99 135.91 60.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.834 -179.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . 0.584 ' CE1' ' HB2' ' A' ' 88' ' ' SER . 74.3 m-85 -135.92 164.79 27.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.445 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.836 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 19.4 m80 -92.32 172.33 8.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.537 179.169 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.43 ' HG ' ' SD ' ' A' ' 101' ' ' MET . 0.5 OUTLIER -65.15 -30.96 71.92 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.341 0.591 . . . . 0.0 110.665 175.232 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.423 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 2.4 pttt -90.11 -13.51 35.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.85 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.836 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 35.4 m -103.77 -20.76 13.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.126 -173.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . 0.519 ' HD1' ' HA ' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -64.85 98.27 0.27 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.269 177.669 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.768 HG21 ' HA ' ' A' ' 121' ' ' ARG . 2.8 p -147.7 160.88 42.21 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -178.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 9.1 p -83.89 153.18 24.13 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 120.815 0.341 . . . . 0.0 110.296 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.16 -16.12 59.25 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.308 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.76 -51.05 5.71 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -173.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.79 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -112.85 -15.63 12.87 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.771 -0.371 . . . . 0.0 111.322 -178.024 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 67.69 36.31 3.68 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 123.624 0.577 . . . . 0.0 110.161 -176.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -73.81 123.51 24.32 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 175.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.768 ' HA ' HG21 ' A' ' 114' ' ' THR . 1.4 mtm180 -74.78 106.46 6.33 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.884 0.374 . . . . 0.0 110.744 -175.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.629 HD21 ' HB2' ' A' ' 128' ' ' PHE . 2.7 mt -66.1 133.94 51.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.007 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.489 HG13 ' HD2' ' A' ' 124' ' ' PRO . 14.8 t -132.85 142.28 44.13 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.695 -171.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.57 ' HD3' ' HE1' ' A' ' 101' ' ' MET . 41.0 Cg_exo -57.09 109.56 0.47 Allowed 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 121.86 1.706 . . . . 0.0 110.72 173.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 117.39 -13.56 13.63 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.561 -174.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -108.29 169.04 8.88 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 175.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.486 ' HB2' ' HB3' ' A' ' 138' ' ' GLU . 8.6 mtt85 -100.49 145.61 28.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.958 0.409 . . . . 0.0 111.374 -174.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.629 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.4 OUTLIER -148.34 171.94 15.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.883 -179.799 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . 0.549 ' CD2' ' HG3' ' A' ' 141' ' ' ARG . 3.3 m-70 -140.92 139.62 34.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.042 0.449 . . . . 0.0 111.282 178.262 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.62 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 46.6 t80 -124.26 103.24 8.12 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.447 HG12 ' H ' ' A' ' 147' ' ' ASN . 13.5 mt -115.56 105.35 18.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.258 -175.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 64.4 24.56 13.23 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.033 174.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.62 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 92.94 31.86 8.31 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.614 -179.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.14 138.93 45.55 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 21.9 mt -96.94 127.74 43.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.957 0.408 . . . . 0.0 111.643 -176.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -135.0 160.9 36.84 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 173.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . 0.597 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 23.7 p -101.79 -171.76 2.03 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.193 0.521 . . . . 0.0 110.461 179.48 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.486 ' HB3' ' HB2' ' A' ' 127' ' ' ARG . 3.6 pt-20 -77.31 -21.44 53.49 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.176 177.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . 0.597 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 72.7 t60 -82.15 -40.84 21.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.485 -175.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.79 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 0.1 OUTLIER -103.24 9.84 37.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.224 -178.005 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.549 ' HG3' ' CD2' ' A' ' 129' ' ' HIS . 15.1 ttp180 -43.9 110.84 1.03 Allowed Pre-proline 0 N--CA 1.468 0.456 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.217 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 6.3 Cg_exo -78.88 107.07 2.19 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 123.279 2.652 . . . . 0.0 112.2 -178.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 16.0 m -79.29 -20.41 48.09 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.166 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.92 -57.45 8.74 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 121.016 0.436 . . . . 0.0 110.462 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 1.7 mp -116.11 81.69 1.65 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.77 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 1.4 tt -110.89 144.51 18.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.299 -174.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . 0.447 ' H ' HG12 ' A' ' 131' ' ' ILE . 56.6 t-20 -69.85 -64.5 0.87 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.942 176.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -119.55 90.57 0.48 Allowed Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.895 -0.669 . . . . 0.0 111.703 178.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -113.49 95.27 0.75 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.964 -0.636 . . . . 0.0 111.998 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -106.36 2.43 26.54 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.318 0.58 . . . . 0.0 110.747 -178.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 124.53 -101.89 0.68 Allowed Glycine 0 N--CA 1.447 -0.571 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -176.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -79.71 50.4 3.84 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.793 -0.717 . . . . 0.0 111.528 176.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -93.17 156.05 17.09 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.209 0.528 . . . . 0.0 111.293 -177.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 161.07 84.37 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 -175.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.88 134.86 56.87 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.049 0.452 . . . . 0.0 112.116 -173.349 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 43.4 mm -66.94 136.56 26.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.623 174.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -52.98 124.95 38.92 Favored Pre-proline 0 C--N 1.331 -0.226 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 176.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . 0.452 ' O ' ' HD1' ' A' ' 407' ' ' PHE . 78.7 Cg_exo -46.31 -82.67 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.576 2.85 . . . . 0.0 113.136 -172.606 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . 0.616 ' CD2' ' HD2' ' A' ' 408' ' ' PRO . 0.2 OUTLIER 169.8 150.64 0.14 Allowed Pre-proline 0 C--N 1.329 -0.293 0 C-N-CA 123.437 0.695 . . . . 0.0 109.181 177.054 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . 0.616 ' HD2' ' CD2' ' A' ' 407' ' ' PHE . 87.0 Cg_endo -85.69 129.7 3.61 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.443 2.096 . . . . 0.0 112.606 174.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -139.53 164.04 30.95 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 177.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -74.71 110.87 9.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.679 0.276 . . . . 0.0 110.441 179.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . 0.408 ' HB2' ' H ' ' A' ' 412' ' ' LEU . . . -84.2 -90.78 0.09 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.941 -176.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.408 ' H ' ' HB2' ' A' ' 411' ' ' ALA . 0.6 OUTLIER -131.4 130.79 22.63 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.564 -176.004 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.18 131.64 35.39 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.843 2.362 . . . . 0.0 111.328 173.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 414' ' ' THR . . . . . 0.668 HG21 ' HA3' ' A' ' 85' ' ' GLY . 68.1 p -110.01 169.22 8.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.871 -172.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 415' ' ' SER . . . . . 0.48 ' HB2' ' H ' ' A' ' 416' ' ' HIS . 0.8 OUTLIER 56.03 -124.35 1.95 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.867 177.166 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . 0.48 ' H ' ' HB2' ' A' ' 415' ' ' SER . 0.2 OUTLIER -117.12 126.56 27.35 Favored Pre-proline 0 C--N 1.329 -0.307 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -178.794 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -69.91 -31.92 18.93 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.843 2.362 . . . . 0.0 112.116 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.412 -0.804 . . . . 0.0 110.889 -179.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.524 0 N-CA-C 112.156 -0.377 . . . . 0.0 112.156 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -95.95 26.76 3.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.21 0.528 . . . . 0.0 111.07 -177.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -95.19 15.68 18.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.146 0.498 . . . . 0.0 110.265 178.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 24.5 mm -94.47 95.3 5.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.559 -176.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -111.83 16.64 20.34 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 175.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.618 HD23 ' N ' ' A' ' 80' ' ' LEU . 1.2 pt? -147.82 123.11 10.26 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.911 -1.04 . . . . 0.0 108.934 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -51.83 -60.02 3.65 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 123.622 0.576 . . . . 0.0 110.433 -175.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.72 124.44 8.02 Favored Glycine 0 N--CA 1.44 -1.068 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 168.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.418 ' HA ' HD13 ' A' ' 80' ' ' LEU . 39.1 t30 -65.01 87.51 0.06 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 117.069 0.434 . . . . 0.0 110.119 -179.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.611 ' H ' HD11 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -148.76 -58.68 0.22 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.402 -178.727 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . 0.469 ' O ' HG22 ' A' ' 414' ' ' THR . . . -150.57 163.29 29.57 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 121.035 -0.602 . . . . 0.0 111.858 179.149 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -167.11 162.19 15.15 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 -178.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.95 143.92 26.09 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.99 14.44 6.16 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -172.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.612 ' HB1' ' HB3' ' A' ' 112' ' ' CYS . . . -112.01 -58.23 2.16 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 121.055 -0.258 . . . . 0.0 111.28 179.504 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.529 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 32.0 p -95.32 -72.85 0.61 Allowed 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.47 -175.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.529 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 130.65 6.78 3.62 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 111.751 -0.54 . . . . 0.0 111.751 -176.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -83.99 117.81 23.63 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 174.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.59 124.28 20.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.703 -177.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.404 HG23 ' HB3' ' A' ' 98' ' ' GLU . 2.4 mt -64.85 111.33 5.57 Favored Pre-proline 0 C--N 1.329 -0.312 0 O-C-N 123.685 0.616 . . . . 0.0 112.119 -171.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.554 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 8.0 Cg_exo -73.63 168.15 25.49 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 123.064 2.509 . . . . 0.0 111.111 173.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.87 -0.49 11.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.868 0.366 . . . . 0.0 111.346 -178.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -116.59 13.25 15.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.009 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.554 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.6 OUTLIER -115.62 142.86 46.17 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.458 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.3 mp -109.64 138.74 45.56 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.291 -177.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.451 HG21 ' HB1' ' A' ' 411' ' ' ALA . 0.1 OUTLIER -120.21 146.96 24.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.558 -178.166 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.495 ' SD ' ' HG3' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -94.98 113.01 24.67 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.864 179.434 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.446 ' H ' ' HG3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -91.25 102.68 15.39 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.721 -177.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -78.93 -35.26 43.61 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.299 0.571 . . . . 0.0 110.163 176.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.437 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 30.3 mt-30 -148.98 -128.72 0.05 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.323 -178.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.437 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -91.19 10.07 75.91 Favored Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 110.988 -0.845 . . . . 0.0 110.988 172.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -120.14 143.81 48.0 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.188 -0.506 . . . . 0.0 109.837 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.414 ' H ' HG23 ' A' ' 107' ' ' VAL . 0.9 OUTLIER -113.72 140.8 32.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.296 0.57 . . . . 0.0 112.411 -173.503 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -131.37 160.69 34.31 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 172.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.844 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 21.7 m80 -83.05 170.39 14.9 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.823 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.454 ' HA ' ' SD ' ' A' ' 101' ' ' MET . 1.7 tp -66.96 -29.35 69.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.289 0.566 . . . . 0.0 109.9 174.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -89.24 -11.18 44.35 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.441 177.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.844 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 34.4 m -108.34 0.17 21.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.049 -176.197 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . 0.461 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.0 OUTLIER -86.04 59.99 5.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.373 0.606 . . . . 0.0 110.3 178.064 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.463 HG21 ' HA ' ' A' ' 121' ' ' ARG . 1.9 p -114.22 155.5 26.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.204 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.496 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 17.1 p -68.99 153.62 43.49 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.174 0.512 . . . . 0.0 110.487 177.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.79 7.44 30.44 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.483 -176.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.48 -51.09 2.82 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -176.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -115.31 -4.52 12.38 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.508 -177.064 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 66.13 32.04 8.4 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.105 -177.062 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . 0.415 ' HB3' ' HB3' ' A' ' 137' ' ' CYS . 58.2 t30 -79.45 124.17 28.22 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.347 177.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.463 ' HA ' HG21 ' A' ' 114' ' ' THR . 1.5 ttp180 -78.87 121.82 25.32 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.725 0.298 . . . . 0.0 110.633 -178.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.485 HD23 ' HB2' ' A' ' 128' ' ' PHE . 1.9 mt -69.61 162.0 28.5 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.202 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 75.8 t -128.64 130.34 23.5 Favored Pre-proline 0 C--N 1.328 -0.331 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.685 -174.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.409 ' HG3' ' HE2' ' A' ' 101' ' ' MET . 36.3 Cg_exo -61.69 111.28 1.14 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.578 2.185 . . . . 0.0 110.81 174.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.11 -18.66 14.03 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.525 -176.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.474 ' O ' ' HA ' ' A' ' 404' ' ' ILE . 2.0 t70 -112.78 -168.91 1.38 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 177.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' A' ' 208' ' ' SER . 0.0 OUTLIER -90.76 147.14 23.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.473 0.654 . . . . 0.0 112.246 -171.441 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.485 ' HB2' HD23 ' A' ' 122' ' ' LEU . 0.4 OUTLIER -145.33 159.77 42.54 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.711 -1.132 . . . . 0.0 108.566 175.274 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . 0.467 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 11.2 m-70 -126.62 122.48 35.14 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.104 0.478 . . . . 0.0 111.299 -178.261 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.43 ' CE2' ' HA2' ' A' ' 133' ' ' GLY . 11.0 t80 -124.97 101.27 6.97 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 173.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 12.3 mt -124.54 124.18 67.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.464 -176.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 60.9 29.47 19.03 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.864 178.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.43 ' HA2' ' CE2' ' A' ' 130' ' ' TYR . . . 75.18 35.27 49.41 Favored Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.563 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.407 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 15.6 m -137.0 146.29 45.15 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.9 mt -98.79 130.4 45.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.346 0.593 . . . . 0.0 111.698 -174.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.496 ' HA ' ' HB2' ' A' ' 115' ' ' CYS . 40.3 m-85 -130.77 163.44 27.31 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.543 172.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . 0.616 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 31.0 p -106.54 -173.36 2.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.087 0.47 . . . . 0.0 111.366 -175.509 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.94 -26.43 59.6 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.492 177.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -77.96 -36.43 49.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.591 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.616 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.2 OUTLIER -57.66 -68.32 0.25 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.876 -1.057 . . . . 0.0 111.142 178.035 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 43.16 71.39 1.45 Allowed Pre-proline 0 N--CA 1.465 0.313 0 O-C-N 123.979 0.799 . . . . 0.0 111.389 -177.432 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -49.96 121.73 7.94 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.769 2.313 . . . . 0.0 112.244 -177.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.88 4.12 51.8 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.655 -176.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -104.2 -63.51 1.2 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.795 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -111.76 113.72 26.26 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.819 0.342 . . . . 0.0 110.236 178.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.99 157.49 28.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.065 179.625 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -78.52 -18.36 54.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.367 0.604 . . . . 0.0 110.217 177.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 168.98 100.83 0.14 Allowed Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.532 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . 0.41 ' HA2' ' OG ' ' A' ' 206' ' ' SER . . . -87.84 53.99 4.3 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.065 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.48 56.9 3.1 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.031 0.443 . . . . 0.0 110.847 -179.156 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 75.11 -78.95 1.05 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.304 -178.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -84.2 64.53 4.25 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.231 -0.509 . . . . 0.0 111.97 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 206' ' ' SER . . . . . 0.41 ' OG ' ' HA2' ' A' ' 202' ' ' GLY . 0.4 OUTLIER -84.93 105.77 15.94 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.953 0.406 . . . . 0.0 111.044 -178.292 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 166.8 118.62 0.44 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.08 178.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 208' ' ' SER . . . . . 0.439 ' O ' ' HA ' ' A' ' 127' ' ' ARG . 0.1 OUTLIER -78.7 165.21 23.88 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 177.422 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . 0.474 ' HA ' ' O ' ' A' ' 126' ' ' ASP . 51.3 mm -87.31 130.84 36.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . 0.415 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -60.56 123.81 75.79 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.92 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . 0.461 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 31.6 Cg_exo -60.22 154.72 50.22 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.967 2.445 . . . . 0.0 112.465 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . 0.438 ' HA ' ' HD3' ' A' ' 408' ' ' PRO . 21.5 m-85 -87.25 148.24 44.32 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.989 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . 0.495 ' HG3' ' SD ' ' A' ' 101' ' ' MET . 9.9 Cg_exo -70.71 138.51 34.94 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.995 2.463 . . . . 0.0 112.089 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -143.14 177.55 8.31 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 177.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -93.53 110.74 22.31 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.861 0.363 . . . . 0.0 110.379 179.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . 0.451 ' HB1' HG21 ' A' ' 100' ' ' VAL . . . -80.5 -91.9 0.05 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.741 179.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.428 ' H ' ' HB2' ' A' ' 411' ' ' ALA . 14.1 tp -131.08 120.25 18.19 Favored Pre-proline 0 C--N 1.325 -0.458 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 178.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -62.12 121.28 9.25 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.221 1.948 . . . . 0.0 111.259 175.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 414' ' ' THR . . . . . 0.469 HG22 ' O ' ' A' ' 85' ' ' GLY . 6.5 m -75.62 153.74 37.09 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.459 -175.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 2.1 m 73.59 82.87 0.12 Allowed 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.478 0.711 . . . . 0.0 110.957 177.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . 0.636 ' HD2' ' HD2' ' A' ' 417' ' ' PRO . 0.1 OUTLIER -61.03 137.49 94.04 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.798 179.635 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . 0.636 ' HD2' ' HD2' ' A' ' 416' ' ' HIS . 95.5 Cg_endo -80.76 10.36 3.37 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.863 2.375 . . . . 0.0 112.635 177.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . 0.519 ' HA ' ' HD2' ' A' ' 418' ' ' LYS . 1.2 mmmt . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.197 -0.906 . . . . 0.0 109.795 178.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.718 0 N-CA-C 111.808 -0.517 . . . . 0.0 111.808 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.38 99.02 0.89 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.238 0.542 . . . . 0.0 111.249 178.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -144.89 158.07 43.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.556 177.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -69.8 110.96 3.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.096 0.474 . . . . 0.0 110.765 -179.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.527 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.3 OUTLIER -102.12 15.76 28.12 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.827 -177.868 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.723 ' HB3' ' HB1' ' A' ' 86' ' ' ALA . 0.1 OUTLIER -145.75 14.41 1.37 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.922 -178.668 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 49.65 -108.61 0.32 Allowed 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.973 -171.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.21 106.58 2.01 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 172.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.488 ' HA ' HD13 ' A' ' 80' ' ' LEU . 0.8 OUTLIER -47.02 113.96 0.76 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 122.795 0.438 . . . . 0.0 111.778 -176.248 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.11 -73.73 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.566 176.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -136.41 127.22 4.07 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.641 -0.79 . . . . 0.0 113.031 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.723 ' HB1' ' HB3' ' A' ' 80' ' ' LEU . . . -149.06 165.25 32.25 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 177.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.33 139.51 39.21 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -20.01 51.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.002 -171.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.698 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -77.79 -43.61 30.1 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.981 -0.288 . . . . 0.0 111.461 -174.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.413 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 26.9 p -103.21 -64.65 1.06 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.137 0.494 . . . . 0.0 110.36 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.527 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 118.11 45.81 0.48 Allowed Glycine 0 N--CA 1.443 -0.892 0 C-N-CA 120.932 -0.651 . . . . 0.0 111.733 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.404 ' NE2' ' H ' ' A' ' 93' ' ' SER . 0.0 OUTLIER -123.42 145.21 48.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.864 0.364 . . . . 0.0 110.261 179.231 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.592 ' HB3' HG23 ' A' ' 414' ' ' THR . 0.0 OUTLIER -67.86 143.03 55.92 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.641 176.766 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.602 HG22 HG13 ' A' ' 100' ' ' VAL . 3.6 mt -111.86 101.84 52.31 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.716 -178.087 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.38 168.45 22.87 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 123.234 2.623 . . . . 0.0 111.519 173.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.49 4.37 4.92 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -175.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -96.67 -17.94 20.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.297 0.57 . . . . 0.0 110.07 177.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -102.86 153.31 20.31 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.327 -174.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -109.67 143.87 38.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.974 0.416 . . . . 0.0 110.921 -176.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.602 HG13 HG22 ' A' ' 94' ' ' ILE . 0.0 OUTLIER -129.0 162.19 36.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.785 -179.482 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.49 113.66 23.12 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.972 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -104.68 117.16 33.4 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.647 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -79.27 -59.76 2.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.768 176.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.28 114.25 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.389 176.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.43 -70.14 3.01 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.257 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -89.85 152.73 21.12 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.822 0.344 . . . . 0.0 110.492 -179.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.456 HG23 ' HB ' ' A' ' 100' ' ' VAL . 3.6 p -119.88 145.5 26.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.345 -177.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . 0.489 ' HD1' ' HB2' ' A' ' 89' ' ' ALA . 86.7 m-85 -137.99 -175.56 4.14 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.781 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.873 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 26.3 m80 -106.38 -179.72 4.02 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.383 -0.228 . . . . 0.0 110.383 179.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.37 -41.96 88.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.132 0.491 . . . . 0.0 110.187 178.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.667 ' HE2' ' SG ' ' A' ' 112' ' ' CYS . 0.1 OUTLIER -80.02 -28.35 39.36 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.367 179.134 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.873 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 27.6 m -79.64 -16.32 56.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.182 -178.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . 0.573 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.0 OUTLIER -76.67 82.15 3.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.251 178.257 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.651 HG23 ' HA ' ' A' ' 121' ' ' ARG . 1.0 OUTLIER -136.35 158.24 44.9 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.131 -178.263 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.525 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 3.4 p -72.26 152.19 42.33 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 176.097 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 2.4 m -87.27 5.44 38.3 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -175.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -114.61 -50.63 2.78 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -176.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.747 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -115.11 6.99 15.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.809 0.338 . . . . 0.0 110.495 -177.959 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.475 ' HG3' ' O ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER 52.13 40.18 28.16 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.266 -179.074 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . 0.71 HD21 ' HB2' ' A' ' 137' ' ' CYS . 40.1 t30 -81.33 130.13 34.91 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.558 178.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.651 ' HA ' HG23 ' A' ' 114' ' ' THR . 0.6 OUTLIER -76.5 123.21 25.69 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.945 -175.918 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.439 HD13 ' HD2' ' A' ' 128' ' ' PHE . 4.6 mt -80.19 138.21 36.82 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.063 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -134.43 139.89 34.11 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.455 -174.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.422 ' HB3' ' CE2' ' A' ' 407' ' ' PHE . 52.8 Cg_exo -54.26 118.95 5.58 Favored 'Trans proline' 0 N--CA 1.463 -0.305 0 C-N-CA 122.575 2.183 . . . . 0.0 111.425 173.417 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 100.27 -0.27 55.89 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.53 -176.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -119.58 -173.35 2.51 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.727 0.299 . . . . 0.0 110.328 177.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -91.88 126.46 36.98 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.984 0.421 . . . . 0.0 111.166 -172.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.467 ' O ' ' HB2' ' A' ' 208' ' ' SER . 0.0 OUTLIER -137.08 135.36 37.41 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 174.802 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -124.07 115.98 22.05 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.142 0.496 . . . . 0.0 111.13 -177.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.455 ' HB2' ' CZ ' ' A' ' 128' ' ' PHE . 6.2 t80 -103.47 101.41 11.3 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 178.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 4.6 mt -118.92 115.28 47.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.622 -176.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 3.3 m120 58.9 31.76 21.61 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.375 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.405 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 80.61 34.36 28.47 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.442 -0.885 . . . . 0.0 112.687 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.486 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 0.4 OUTLIER -139.69 140.17 36.78 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 -179.55 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.3 mt -91.1 122.23 33.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.073 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.525 ' HA ' ' HB2' ' A' ' 115' ' ' CYS . 70.6 m-85 -128.74 158.88 37.37 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.622 176.25 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . 0.71 ' HB2' HD21 ' A' ' 120' ' ' ASN . 8.5 p -114.08 -168.97 1.43 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.017 0.437 . . . . 0.0 111.35 -177.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.25 -22.47 48.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.053 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . 0.704 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 37.2 m-70 -78.16 -28.93 48.4 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 120.997 0.427 . . . . 0.0 110.574 -176.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.747 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 0.8 OUTLIER -123.02 29.04 6.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.471 -178.6 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.418 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 45.0 ttt180 -51.55 111.19 2.21 Favored Pre-proline 0 N--CA 1.469 0.521 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.706 -178.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 1.0 OUTLIER -84.81 83.08 1.63 Allowed 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 123.366 2.71 . . . . 0.0 112.17 -178.78 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' THR . . . . . 0.638 ' HA ' HD12 ' A' ' 146' ' ' ILE . 0.1 OUTLIER -67.8 -1.02 4.71 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -178.586 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -67.46 -17.34 64.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.799 0.333 . . . . 0.0 111.385 179.212 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.402 ' HB3' ' H ' ' A' ' 146' ' ' ILE . 3.9 tp -143.21 -102.37 0.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.685 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.638 HD12 ' HA ' ' A' ' 143' ' ' THR . 56.4 mt 62.73 101.56 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-O 121.059 0.457 . . . . 0.0 111.292 -175.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -68.36 98.73 0.86 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.205 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 99.17 23.25 11.56 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.849 -0.691 . . . . 0.0 111.81 -177.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -79.37 64.16 3.83 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 121.346 -0.454 . . . . 0.0 112.117 177.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.28 87.43 1.48 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.791 0.329 . . . . 0.0 110.849 178.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 69.33 -105.04 1.4 Allowed Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.165 179.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -93.67 -5.12 63.29 Favored Glycine 0 N--CA 1.445 -0.73 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.245 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 14.5 m -62.46 136.39 57.88 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.4 0.619 . . . . 0.0 111.86 -176.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -154.01 -163.16 11.64 Favored Glycine 0 N--CA 1.446 -0.687 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.974 178.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 208' ' ' SER . . . . . 0.467 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 43.9 m -114.83 160.16 19.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.36 0.6 . . . . 0.0 111.311 -179.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . 0.498 HG22 HD12 ' A' ' 404' ' ' ILE . 5.4 mm -111.57 138.16 41.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.357 178.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -58.8 123.87 70.35 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-O 120.909 0.385 . . . . 0.0 111.532 -178.063 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . 0.573 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 31.4 Cg_exo -59.81 161.61 17.98 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.293 2.662 . . . . 0.0 112.491 177.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . 0.422 ' CE2' ' HB3' ' A' ' 124' ' ' PRO . 34.1 m-85 -94.77 156.46 38.19 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.481 -177.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.3 140.46 44.45 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.895 2.397 . . . . 0.0 112.752 179.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -144.82 175.78 9.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.516 178.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -98.08 109.74 22.44 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 174.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -85.77 -89.35 0.11 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.447 -175.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.477 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 2.1 tp -131.21 128.88 22.26 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.157 -178.021 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 3.2 Cg_exo -75.6 155.41 40.19 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.911 2.407 . . . . 0.0 111.913 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 414' ' ' THR . . . . . 0.592 HG23 ' HB3' ' A' ' 93' ' ' SER . 0.2 OUTLIER -83.06 176.5 9.18 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.772 177.055 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 415' ' ' SER . . . . . 0.45 ' O ' ' HD3' ' A' ' 417' ' ' PRO . 0.2 OUTLIER -53.5 137.74 35.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.179 177.515 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 14.7 m170 -86.35 110.68 33.37 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.596 -178.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . 0.45 ' HD3' ' O ' ' A' ' 415' ' ' SER . 68.0 Cg_endo -90.85 -32.21 0.1 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.73 2.286 . . . . 0.0 113.211 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . 0.432 ' HZ2' ' HG3' ' A' ' 418' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.246 0.899 0 CA-C-O 118.376 -0.821 . . . . 0.0 111.178 -175.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.619 0 N-CA-C 112.01 -0.436 . . . . 0.0 112.01 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.49 166.13 29.09 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.839 0.352 . . . . 0.0 110.465 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -134.34 107.45 7.63 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.718 0.294 . . . . 0.0 110.595 178.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 37.5 mt -118.82 126.92 75.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.341 -179.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.427 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.1 OUTLIER -126.49 -32.79 2.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.249 0.547 . . . . 0.0 110.329 177.537 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.702 HD11 ' H ' ' A' ' 84' ' ' SER . 1.5 pt? -98.86 155.31 17.45 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.597 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -73.22 -78.96 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.849 0.356 . . . . 0.0 111.077 -176.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -77.27 96.58 1.24 Allowed Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.473 -0.87 . . . . 0.0 111.17 175.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.493 ' HA ' HD11 ' A' ' 80' ' ' LEU . 58.4 t30 -56.41 100.69 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.229 0.537 . . . . 0.0 111.865 -174.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.702 ' H ' HD11 ' A' ' 80' ' ' LEU . 4.4 m -153.99 -62.15 0.13 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.708 175.53 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -141.73 118.56 1.34 Allowed Glycine 0 C--N 1.333 0.399 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.735 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.471 ' HB3' ' HB3' ' A' ' 80' ' ' LEU . . . -135.78 149.25 49.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.761 0.315 . . . . 0.0 110.424 179.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.826 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 3.3 t -57.18 145.93 29.77 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.262 177.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.5 m -99.63 -1.38 38.19 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.861 172.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.655 ' HB1' ' HB3' ' A' ' 112' ' ' CYS . . . -102.22 -59.26 1.73 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.014 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 30.7 p -93.98 -31.6 14.19 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 120.265 -0.574 . . . . 0.0 109.862 176.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.826 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 92.83 14.45 55.05 Favored Glycine 0 N--CA 1.45 -0.394 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.953 172.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -89.69 146.84 24.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.722 0.261 . . . . 0.0 110.759 178.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.533 ' HB2' HG21 ' A' ' 414' ' ' THR . 0.0 OUTLIER -66.08 140.31 58.24 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.457 176.984 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.7 mt -110.78 119.34 46.44 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -174.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -78.37 155.53 28.66 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.938 2.425 . . . . 0.0 110.628 167.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.552 ' HB3' ' HG3' ' A' ' 413' ' ' PRO . . . -68.07 -15.23 63.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.972 0.415 . . . . 0.0 111.116 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.94 -5.37 53.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.633 178.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -111.43 120.22 41.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.638 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.5 tp -76.1 128.53 35.18 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.968 0.413 . . . . 0.0 110.786 -178.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -116.59 140.02 40.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.335 -179.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.94 112.6 20.3 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.397 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.45 ' HD3' ' OE2' ' A' ' 409' ' ' GLU . 0.0 OUTLIER -88.42 150.46 23.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.175 -176.118 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -130.58 -134.78 0.21 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.331 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.73 69.75 3.14 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.093 0.473 . . . . 0.0 110.561 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 85.42 -25.79 6.14 Favored Glycine 0 N--CA 1.452 -0.275 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.435 179.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -89.35 156.14 18.9 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.734 0.302 . . . . 0.0 111.044 -177.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.29 132.59 67.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.791 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . 0.426 ' HD1' ' HB3' ' A' ' 89' ' ' ALA . 44.8 m-85 -128.15 171.28 12.07 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.332 176.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.917 ' H ' ' HB2' ' A' ' 112' ' ' CYS . 23.8 m80 -101.36 179.22 4.42 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 177.159 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.7 mt -62.34 -28.61 69.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.227 0.537 . . . . 0.0 110.698 177.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.506 ' HG3' ' H ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.06 -34.37 15.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.289 176.919 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.917 ' HB2' ' H ' ' A' ' 109' ' ' HIS . 4.2 m -78.78 -5.7 54.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.836 -175.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -96.38 66.0 2.37 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 172.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.826 HG21 ' HA ' ' A' ' 121' ' ' ARG . 0.5 OUTLIER -119.97 158.03 27.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.76 -178.95 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.556 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 5.6 t -62.61 152.5 34.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.292 173.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.2 m -87.1 -32.89 19.67 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.799 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -99.12 -51.59 3.79 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -174.006 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.466 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 8.3 p -90.23 -20.33 23.13 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.89 0.376 . . . . 0.0 110.116 178.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.556 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 69.52 25.28 5.4 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.844 175.201 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . 0.466 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 5.1 m-80 -70.1 128.35 35.99 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 174.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.826 ' HA ' HG21 ' A' ' 114' ' ' THR . 9.7 ttp85 -65.64 116.99 7.45 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 176.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 19.9 mt -65.5 151.99 45.07 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.731 0.301 . . . . 0.0 110.345 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 90.7 t -123.47 131.31 24.3 Favored Pre-proline 0 C--N 1.325 -0.466 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.651 -171.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -65.01 110.43 1.5 Allowed 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 121.814 1.676 . . . . 0.0 110.596 172.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.52 -17.05 14.15 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.415 -173.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -117.33 -161.18 0.8 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.82 150.34 27.9 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -169.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.538 ' O ' ' HB2' ' A' ' 208' ' ' SER . 0.0 OUTLIER -157.62 135.82 11.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.251 172.175 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -126.09 128.59 47.6 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.89 0.376 . . . . 0.0 110.574 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -124.81 102.56 7.62 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.836 -178.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.732 HD13 ' HG2' ' A' ' 142' ' ' PRO . 2.6 mp -131.32 130.43 63.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 -179.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.51 32.14 20.42 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 123.463 0.477 . . . . 0.0 110.248 -179.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 64.87 36.09 92.68 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.523 -177.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -131.62 147.85 52.56 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.464 -0.433 . . . . 0.0 109.884 -179.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 13.7 mt -101.26 115.06 29.63 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.322 -174.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -122.16 173.32 7.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.67 174.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . 0.765 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 29.4 p -119.09 -165.93 1.2 Allowed 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 177.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.09 -25.99 47.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.265 0.555 . . . . 0.0 109.51 175.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . 0.765 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 68.4 t60 -74.57 -24.34 58.9 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.256 -0.884 . . . . 0.0 108.738 176.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.462 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 1.7 m-20 -113.8 23.73 12.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.486 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.412 HH21 ' CB ' ' A' ' 206' ' ' SER . 24.5 ttt-85 -62.88 115.14 15.13 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.125 -175.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.732 ' HG2' HD13 ' A' ' 131' ' ' ILE . 44.9 Cg_exo -56.89 114.87 2.12 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.042 2.494 . . . . 0.0 112.645 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -18.25 56.95 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.762 -179.016 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -99.05 -98.88 0.22 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.251 -175.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.42 75.84 10.2 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.326 -176.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.402 ' H ' HG21 ' A' ' 146' ' ' ILE . 5.4 tt -97.51 120.89 47.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 175.091 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . 0.463 ' H ' HG12 ' A' ' 131' ' ' ILE . 5.4 t30 -89.84 74.92 7.35 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.201 0.524 . . . . 0.0 110.394 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 158.74 44.15 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.711 -178.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -84.65 46.69 3.72 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.026 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.67 82.01 1.13 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.008 0.432 . . . . 0.0 110.8 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 73.28 -102.0 1.21 Allowed Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.803 -0.713 . . . . 0.0 111.568 -178.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -75.75 -15.88 81.01 Favored Glycine 0 CA--C 1.518 0.24 0 C-N-CA 121.258 -0.496 . . . . 0.0 112.626 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 206' ' ' SER . . . . . 0.412 ' CB ' HH21 ' A' ' 141' ' ' ARG . 0.7 OUTLIER 59.56 67.17 0.91 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 122.705 0.402 . . . . 0.0 111.379 179.721 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -133.5 130.02 5.55 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.873 -0.679 . . . . 0.0 111.634 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 208' ' ' SER . . . . . 0.538 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -120.66 138.66 53.82 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.947 0.403 . . . . 0.0 111.431 -178.849 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 35.5 mm -101.06 142.16 16.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.836 178.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . 0.424 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -52.9 136.52 46.48 Favored Pre-proline 0 C--O 1.233 0.218 0 CA-C-O 120.757 0.313 . . . . 0.0 111.209 177.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . 0.488 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 11.7 Cg_exo -72.17 2.17 5.24 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.521 2.814 . . . . 0.0 113.335 -174.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . 0.488 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 10.0 m-85 73.89 156.95 0.16 Allowed Pre-proline 0 N--CA 1.469 0.505 0 O-C-N 123.673 0.608 . . . . 0.0 111.395 178.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -83.71 136.02 7.1 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.882 2.388 . . . . 0.0 112.05 177.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . 0.45 ' OE2' ' HD3' ' A' ' 102' ' ' ARG . 1.0 OUTLIER -137.87 177.82 7.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.162 179.358 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -97.31 126.55 42.6 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.786 0.327 . . . . 0.0 110.626 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -94.84 -168.25 1.78 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.377 178.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.439 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.4 OUTLIER -71.86 128.62 89.22 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.394 179.708 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . 0.552 ' HG3' ' HB3' ' A' ' 96' ' ' ALA . 10.0 Cg_exo -72.2 130.42 16.4 Favored 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 122.959 2.439 . . . . 0.0 112.626 -175.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 414' ' ' THR . . . . . 0.533 HG21 ' HB2' ' A' ' 93' ' ' SER . 0.4 OUTLIER -79.29 161.18 26.45 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.1 178.122 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.88 157.1 22.36 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -92.04 152.87 43.17 Favored Pre-proline 0 C--O 1.233 0.221 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.073 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -78.89 178.35 7.64 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.647 2.232 . . . . 0.0 112.154 176.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 1.3 mmtm . . . . . 0 C--O 1.245 0.848 0 CA-C-O 118.455 -0.783 . . . . 0.0 110.601 -178.652 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.591 0 N-CA-C 111.77 -0.532 . . . . 0.0 111.77 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.36 -45.3 2.93 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.814 0.34 . . . . 0.0 110.332 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 1.9 t80 57.93 43.91 20.61 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.092 179.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -112.19 127.88 69.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.907 0.384 . . . . 0.0 110.789 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -145.47 22.38 1.49 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.36 178.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.658 ' HB2' ' HA ' ' A' ' 83' ' ' ASN . 0.8 OUTLIER -140.46 131.14 25.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.757 -177.867 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -81.1 104.41 11.57 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 176.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.43 5.43 86.99 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.468 -0.873 . . . . 0.0 111.892 -177.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.658 ' HA ' ' HB2' ' A' ' 80' ' ' LEU . 23.5 t-20 59.7 55.6 3.92 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.133 0.492 . . . . 0.0 111.434 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 29.1 m -157.96 107.4 2.09 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.415 175.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.36 133.29 1.79 Allowed Glycine 0 CA--C 1.519 0.328 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.824 178.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.527 ' HB2' HD21 ' A' ' 80' ' ' LEU . . . -167.4 150.71 6.28 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 177.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.93 145.96 30.61 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.15 -10.76 59.06 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.08 -170.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.589 ' CB ' ' HB3' ' A' ' 112' ' ' CYS . . . -85.14 -46.91 10.66 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.164 -176.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.553 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 30.5 p -102.95 -77.35 0.56 Allowed 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.873 -178.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.553 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 147.33 -1.12 0.72 Allowed Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.742 -177.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -83.21 146.02 28.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.895 0.379 . . . . 0.0 110.181 177.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 86' ' ' ALA . 1.2 m -76.48 169.09 18.91 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.159 176.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.546 HG12 HG13 ' A' ' 100' ' ' VAL . 2.7 mt -111.25 104.74 56.52 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-O 120.744 0.307 . . . . 0.0 111.244 -176.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.909 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 2.9 Cg_exo -76.29 167.75 25.22 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.853 2.369 . . . . 0.0 111.012 173.039 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.24 -9.01 51.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.06 0.457 . . . . 0.0 111.195 -178.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.31 -10.77 34.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.876 178.332 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.909 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 3.3 mm-40 -101.81 163.13 12.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.506 -179.333 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.671 ' HB2' HD12 ' A' ' 110' ' ' LEU . 10.3 mt -132.66 133.75 43.97 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.524 -178.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.546 HG13 HG12 ' A' ' 94' ' ' ILE . 2.0 m -118.21 148.97 20.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.828 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.501 ' HE2' ' HD2' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -95.64 121.97 37.91 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 175.844 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.524 ' HA ' HG13 ' A' ' 107' ' ' VAL . 14.4 ttt85 -88.52 129.21 35.52 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.47 -175.301 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -112.22 -147.93 0.42 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.59 77.79 2.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.934 0.397 . . . . 0.0 110.736 178.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.5 -42.39 2.7 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.857 -0.611 . . . . 0.0 112.603 176.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -89.7 156.24 18.68 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.838 0.351 . . . . 0.0 110.797 -178.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.524 HG13 ' HA ' ' A' ' 102' ' ' ARG . 0.4 OUTLIER -127.95 148.87 32.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.592 179.688 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -136.63 149.92 48.25 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 178.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.884 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 33.9 m80 -71.35 171.35 11.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.902 0.382 . . . . 0.0 110.798 -177.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.671 HD12 ' HB2' ' A' ' 99' ' ' LEU . 0.3 OUTLIER -61.26 -26.19 67.59 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.101 0.477 . . . . 0.0 111.171 175.971 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.448 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.82 -20.64 22.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.881 177.478 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.884 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 7.5 m -100.31 -18.65 16.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.184 -170.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . 0.501 ' HD2' ' HE2' ' A' ' 101' ' ' MET . 1.5 t80 -67.6 83.57 0.18 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.086 0.47 . . . . 0.0 110.201 176.502 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 2.5 p -135.67 160.63 37.91 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.528 -174.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.541 ' HB3' ' H ' ' A' ' 120' ' ' ASN . 37.2 t -60.88 154.18 22.86 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.626 177.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 1.2 m -95.64 -10.39 29.53 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.092 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -107.94 -52.48 2.76 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.839 -0.345 . . . . 0.0 111.815 -179.444 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.413 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -98.97 -20.09 16.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.11 0.481 . . . . 0.0 109.96 179.124 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.509 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.1 OUTLIER 64.94 37.54 6.91 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.891 -178.288 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . 0.542 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 72.8 m-20 -75.53 140.95 43.05 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 174.394 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.6 112.41 14.37 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 176.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.461 HD12 ' HB2' ' A' ' 128' ' ' PHE . 10.0 mt -70.7 152.46 43.81 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.362 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.419 HG11 ' N ' ' A' ' 124' ' ' PRO . 8.9 t -119.09 135.04 23.65 Favored Pre-proline 0 C--N 1.325 -0.468 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.955 -168.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.419 ' N ' HG11 ' A' ' 123' ' ' VAL . 40.2 Cg_exo -56.99 111.59 0.85 Allowed 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 122.581 2.187 . . . . 0.0 111.207 174.264 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.59 5.9 56.6 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.513 -178.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -126.05 -173.95 2.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.757 0.313 . . . . 0.0 111.043 177.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.449 ' HA ' ' O ' ' A' ' 208' ' ' SER . 6.9 mmt-85 -73.86 136.64 43.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.383 0.611 . . . . 0.0 112.294 -171.131 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.461 ' HB2' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -148.84 153.28 37.86 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.966 -1.015 . . . . 0.0 108.578 175.517 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -135.45 133.62 38.76 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.492 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.401 ' HA ' ' O ' ' A' ' 134' ' ' SER . 5.1 t80 -126.17 102.11 7.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.378 175.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 2.8 mp -127.68 128.04 69.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 -178.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.5 m120 61.02 32.56 19.86 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.579 0.549 . . . . 0.0 111.016 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 68.07 35.27 83.4 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.436 -0.888 . . . . 0.0 112.037 -178.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.401 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.7 OUTLIER -138.41 146.91 42.77 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -178.253 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 9.6 mt -99.34 129.12 45.52 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.899 0.38 . . . . 0.0 110.617 -176.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -129.44 161.24 30.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.501 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . 0.542 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 6.1 m -93.31 176.1 6.52 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.059 0.456 . . . . 0.0 109.831 175.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.95 -14.22 59.61 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 162.247 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . 0.449 ' HB3' ' HB2' ' A' ' 137' ' ' CYS . 67.8 t60 -70.11 -46.83 63.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.129 -1.396 . . . . 0.0 110.517 177.221 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.413 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 1.9 p-10 -109.83 13.52 23.54 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.281 -177.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.49 ' HE ' ' HB2' ' A' ' 206' ' ' SER . 22.2 ttt-85 -47.55 114.4 3.1 Favored Pre-proline 0 N--CA 1.468 0.445 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.998 -177.201 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 6.0 Cg_exo -79.85 118.92 3.86 Favored 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 123.286 2.657 . . . . 0.0 112.262 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -11.21 60.66 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -99.24 -18.61 17.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.949 0.404 . . . . 0.0 111.355 -179.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 1.2 mt -127.79 83.4 2.16 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.009 0.433 . . . . 0.0 110.31 -178.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -139.5 139.94 37.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.035 -179.105 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -100.39 78.0 1.99 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.081 0.467 . . . . 0.0 110.18 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 100.16 173.16 30.05 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.107 -178.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . 0.639 ' HA3' ' HG ' ' A' ' 206' ' ' SER . . . 123.18 148.22 7.54 Favored Glycine 0 N--CA 1.442 -0.909 0 C-N-CA 120.782 -0.723 . . . . 0.0 111.898 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 2.6 m -112.68 35.96 3.64 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.22 0.533 . . . . 0.0 110.797 -178.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 123.71 -62.01 0.57 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.775 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -75.97 -44.69 18.29 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.254 178.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 206' ' ' SER . . . . . 0.639 ' HG ' ' HA3' ' A' ' 202' ' ' GLY . 7.8 m 50.82 65.02 1.59 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 122.462 0.305 . . . . 0.0 111.172 -178.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -110.34 85.49 0.4 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.588 -178.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 208' ' ' SER . . . . . 0.449 ' O ' ' HA ' ' A' ' 127' ' ' ARG . 0.0 OUTLIER -73.09 148.58 43.86 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.862 0.363 . . . . 0.0 110.599 178.731 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 48.3 mm -104.42 136.89 35.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.348 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -60.82 126.11 84.67 Favored Pre-proline 0 C--N 1.33 -0.261 0 O-C-N 123.42 0.45 . . . . 0.0 109.955 176.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . 0.559 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 82.9 Cg_exo -44.05 -71.06 0.06 OUTLIER 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.722 2.948 . . . . 0.0 113.133 -173.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . 0.559 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 0.2 OUTLIER 149.92 157.93 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.691 0 C-N-CA 125.185 1.394 . . . . 0.0 108.739 177.558 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . 0.505 ' HD2' ' CD2' ' A' ' 407' ' ' PHE . 39.7 Cg_exo -61.42 132.29 40.23 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.692 2.261 . . . . 0.0 112.05 174.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -138.4 154.38 48.91 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.956 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -86.73 130.84 34.32 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 176.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . 0.445 ' HB2' ' H ' ' A' ' 412' ' ' LEU . . . -107.38 -120.3 0.25 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.258 -177.334 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.445 ' H ' ' HB2' ' A' ' 411' ' ' ALA . 0.2 OUTLIER -96.38 129.13 34.23 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.156 -179.217 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 20.7 Cg_exo -66.17 151.23 84.13 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 123.213 2.609 . . . . 0.0 112.771 -177.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 26.5 m -68.32 141.96 55.65 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.815 177.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 12.6 p 62.59 179.08 0.14 Allowed 'General case' 0 N--CA 1.467 0.376 0 O-C-N 124.094 0.871 . . . . 0.0 111.704 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -112.13 91.63 16.4 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 172.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -81.47 8.95 4.1 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.036 2.491 . . . . 0.0 112.429 -176.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.635 -0.698 . . . . 0.0 110.498 -178.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.746 0 N-CA-C 111.997 -0.441 . . . . 0.0 111.997 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.59 66.69 2.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.976 0.417 . . . . 0.0 111.462 -178.393 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -118.22 149.37 41.21 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 177.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -98.88 127.53 51.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.993 0.901 . . . . 0.0 112.558 -169.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.7 ttp180 -138.7 12.38 2.71 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.535 -1.211 . . . . 0.0 108.018 169.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.624 ' HB3' ' HA ' ' A' ' 83' ' ' ASN . 2.6 mm? -105.77 117.53 34.26 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 114.582 -1.19 . . . . 0.0 110.681 -173.056 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -70.36 -48.5 56.04 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.706 178.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -102.87 -12.8 31.19 Favored Glycine 0 N--CA 1.454 -0.155 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.203 178.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.624 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 1.4 t30 67.77 37.36 3.23 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.083 0.468 . . . . 0.0 111.243 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -116.16 -69.84 0.83 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.801 179.233 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . 0.438 ' O ' ' HA ' ' A' ' 93' ' ' SER . . . -133.64 143.42 15.1 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.983 -0.627 . . . . 0.0 111.999 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -147.88 170.77 16.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.708 0.254 . . . . 0.0 110.679 -177.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.662 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 50.4 t -75.01 145.77 42.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.567 179.144 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.7 m -80.93 -9.6 59.81 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.372 176.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -113.75 -58.01 2.21 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.802 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 37.7 m -71.19 -43.04 68.2 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.481 0.658 . . . . 0.0 109.972 178.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.662 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 87.2 0.28 85.21 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.586 -176.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.03 132.37 38.91 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.438 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 0.0 OUTLIER -57.89 123.38 15.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 175.917 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.575 HG23 HG13 ' A' ' 100' ' ' VAL . 8.0 mt -79.24 117.13 65.27 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.26 -176.294 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.537 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 2.7 Cg_exo -77.66 158.89 31.97 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 123.098 2.532 . . . . 0.0 111.271 174.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.409 ' HB2' ' HB3' ' A' ' 413' ' ' PRO . . . -66.37 -21.76 66.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.226 0.536 . . . . 0.0 111.001 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.96 2.39 30.95 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.509 -179.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.537 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -107.88 159.32 16.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.075 0.464 . . . . 0.0 110.904 -178.732 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.2 mt -121.42 124.66 45.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.574 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.575 HG13 HG23 ' A' ' 94' ' ' ILE . 19.2 m -123.44 169.51 14.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.135 -173.761 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -115.77 112.26 21.75 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.22 0.533 . . . . 0.0 109.943 178.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.71 98.06 10.18 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.261 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -74.64 -45.37 45.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.504 178.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.495 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -161.53 -129.18 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -179.988 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.495 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -66.24 -22.37 70.88 Favored Glycine 0 N--CA 1.451 -0.326 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 173.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -89.15 135.37 33.6 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 2.5 p -123.12 128.24 74.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.442 -177.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . 0.544 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 38.7 m-85 -125.49 176.61 6.71 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.147 -179.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.789 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 70.4 m80 -99.42 -149.58 0.36 Allowed 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 175.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.459 ' H ' ' HG ' ' A' ' 110' ' ' LEU . 0.0 OUTLIER -86.87 -30.12 21.66 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.146 174.4 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.8 -34.02 16.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.797 0.332 . . . . 0.0 111.863 -172.239 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.789 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.1 OUTLIER -75.74 -19.4 59.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.261 0.553 . . . . 0.0 110.498 -176.402 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -76.41 72.31 3.13 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.412 176.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.1 p -137.79 157.95 45.37 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.453 -178.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.454 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 11.4 p -79.02 154.25 29.62 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 120.867 0.365 . . . . 0.0 110.247 176.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -53.78 18.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -174.128 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.6 -50.8 14.43 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -168.164 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.31 -13.58 19.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.595 0.236 . . . . 0.0 111.422 -175.249 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.454 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.9 OUTLIER 63.33 42.98 6.44 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.658 -179.389 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -77.99 122.7 25.88 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.408 176.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.25 122.68 22.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.733 0.301 . . . . 0.0 110.683 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.443 HD22 ' HB2' ' A' ' 128' ' ' PHE . 8.9 mt -71.83 143.08 49.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 176.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.3 t -139.17 138.36 20.73 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-O 121.031 0.443 . . . . 0.0 111.568 -166.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.3 110.98 1.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.576 2.184 . . . . 0.0 110.865 175.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 120.77 -15.86 9.61 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 -175.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -113.72 -159.44 0.69 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 127' ' ' ARG . 0.0 OUTLIER -118.99 129.36 55.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.158 0.504 . . . . 0.0 111.444 -175.754 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.443 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.6 OUTLIER -117.53 138.64 51.76 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 172.538 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -104.88 108.98 20.76 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.93 0.395 . . . . 0.0 111.068 -177.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -95.77 100.86 12.52 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 174.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.427 ' HA ' ' OD1' ' A' ' 147' ' ' ASN . 57.1 mt -122.95 122.88 66.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.089 -175.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.4 t30 58.85 28.77 17.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.599 -176.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 73.38 32.66 59.68 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.34 -178.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 3.9 m -132.57 155.92 47.8 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 -177.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 67.3 mt -95.72 116.62 29.14 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 123.242 0.339 . . . . 0.0 110.821 -176.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -125.79 150.83 47.47 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.916 177.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . 0.548 ' SG ' ' HB2' ' A' ' 139' ' ' HIS . 17.8 p -99.47 -172.39 2.25 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.357 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -77.56 -20.83 53.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.873 0.368 . . . . 0.0 110.744 177.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . 0.548 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 1.0 OUTLIER -81.81 -38.82 24.95 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 178.252 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.418 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 2.0 m-20 -74.74 -31.24 61.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.586 178.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -20.79 101.88 0.07 OUTLIER Pre-proline 0 N--CA 1.47 0.538 0 O-C-N 125.294 1.621 . . . . 0.0 114.103 -177.033 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -70.74 162.61 41.98 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 122.901 2.401 . . . . 0.0 112.322 176.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' THR . . . . . 0.417 ' O ' ' HB2' ' A' ' 144' ' ' ALA . 98.4 m -110.12 150.4 28.65 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.89 176.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 143' ' ' THR . . . 73.94 -62.04 0.48 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.399 0.679 . . . . 0.0 111.607 178.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.62 62.29 7.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.094 0.473 . . . . 0.0 110.206 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.458 ' H ' HG13 ' A' ' 146' ' ' ILE . 0.0 OUTLIER -117.54 78.37 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.311 178.173 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . 0.427 ' OD1' ' HA ' ' A' ' 131' ' ' ILE . 0.8 OUTLIER -70.09 -17.42 63.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.608 -176.986 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -114.61 24.25 11.32 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.927 178.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -134.75 123.99 3.32 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.085 -178.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.83 82.38 7.52 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 174.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 78.39 -59.02 4.06 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 -176.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -134.99 -114.82 1.45 Allowed Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 111.126 -0.79 . . . . 0.0 111.126 175.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -82.5 99.4 9.46 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.045 0.45 . . . . 0.0 111.067 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -126.48 28.09 4.83 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.915 -0.659 . . . . 0.0 111.868 179.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.09 162.74 34.21 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 -177.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . 0.428 ' O ' ' HD1' ' A' ' 128' ' ' PHE . 15.4 mm -125.05 -94.03 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 O-C-N 123.292 0.37 . . . . 0.0 110.067 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . 0.435 ' HA ' ' CD1' ' A' ' 128' ' ' PHE . . . -169.9 157.34 6.25 Favored Pre-proline 0 C--O 1.234 0.244 0 N-CA-C 110.41 -0.219 . . . . 0.0 110.41 -177.224 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . 0.483 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 73.6 Cg_endo -77.76 -19.3 12.78 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.293 1.995 . . . . 0.0 111.318 174.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . 0.483 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 4.4 m-85 76.17 149.93 0.13 Allowed Pre-proline 0 CA--C 1.533 0.312 0 O-C-N 124.419 1.074 . . . . 0.0 111.381 177.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.38 116.54 4.35 Favored 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.564 2.176 . . . . 0.0 112.646 178.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -136.8 177.31 7.96 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.927 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -89.58 134.33 34.18 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.144 -179.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -107.21 -166.38 1.15 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.429 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 2.4 mp -67.64 122.49 83.65 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.321 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 7.0 Cg_exo -72.92 135.85 24.05 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 123.088 2.525 . . . . 0.0 113.04 -175.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 414' ' ' THR . . . . . 0.436 HG22 ' N ' ' A' ' 415' ' ' SER . 0.4 OUTLIER -67.08 153.39 43.78 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.601 176.06 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 415' ' ' SER . . . . . 0.436 ' N ' HG22 ' A' ' 414' ' ' THR . 1.1 m -64.72 167.72 7.03 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -69.18 139.9 90.33 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.878 -179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -91.69 -165.2 0.15 Allowed 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 123.429 2.753 . . . . 0.0 112.853 -178.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.773 -0.632 . . . . 0.0 110.024 177.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.828 0 N-CA-C 111.849 -0.501 . . . . 0.0 111.849 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.14 88.95 2.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.018 0.437 . . . . 0.0 111.047 -179.138 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -118.07 -1.28 11.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.148 0.499 . . . . 0.0 110.86 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -81.31 65.01 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.407 0.623 . . . . 0.0 111.53 -175.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.26 -9.24 22.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.085 177.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.575 ' HG ' ' HB1' ' A' ' 86' ' ' ALA . 5.1 mp -99.53 14.42 29.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.72 -173.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.544 ' HB2' ' OG ' ' A' ' 93' ' ' SER . 0.2 OUTLIER 47.58 56.25 7.31 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 123.624 0.578 . . . . 0.0 112.184 176.322 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.33 5.2 59.34 Favored Glycine 0 C--N 1.327 0.046 0 C-N-CA 120.429 -0.891 . . . . 0.0 111.981 -178.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.455 ' HA ' ' CB ' ' A' ' 80' ' ' LEU . 61.3 t30 69.24 65.49 0.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 123.68 0.792 . . . . 0.0 112.285 175.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.507 ' CB ' ' HA ' ' A' ' 414' ' ' THR . 0.1 OUTLIER -106.36 -55.28 2.35 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.981 173.382 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -162.95 167.36 37.3 Favored Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.575 ' HB1' ' HG ' ' A' ' 80' ' ' LEU . . . -153.31 135.16 14.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.71 0.29 . . . . 0.0 110.661 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.441 ' HB2' ' CE1' ' A' ' 109' ' ' HIS . 19.0 t -67.4 145.43 55.04 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.336 175.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.7 m -79.11 -0.14 30.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.356 178.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -124.95 -55.78 1.58 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.68 -0.236 . . . . 0.0 111.188 176.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 25.4 m -76.37 -26.67 55.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.786 0.327 . . . . 0.0 111.137 -178.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.25 32.68 84.59 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.287 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.426 ' NE2' ' H ' ' A' ' 93' ' ' SER . 0.0 OUTLIER -119.63 162.5 18.87 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.631 0.253 . . . . 0.0 110.406 179.831 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.544 ' OG ' ' HB2' ' A' ' 81' ' ' PHE . 0.7 OUTLIER -78.64 171.09 15.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.998 -178.684 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.526 HG23 HG13 ' A' ' 100' ' ' VAL . 2.3 mp -127.44 119.68 21.84 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.058 -175.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.663 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 7.8 Cg_exo -74.11 167.53 26.96 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.817 2.345 . . . . 0.0 111.12 171.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.4 -12.4 61.39 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.086 0.469 . . . . 0.0 111.183 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.98 -14.03 34.88 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.168 -179.007 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.663 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -94.92 102.7 14.55 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.032 0.444 . . . . 0.0 110.966 -174.445 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 62.5 mt -71.66 126.59 30.1 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 173.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.646 ' HB ' ' O ' ' A' ' 108' ' ' TYR . 13.8 m -122.25 149.11 25.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.094 -174.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.28 153.75 21.76 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.402 ' HB3' HG11 ' A' ' 107' ' ' VAL . 0.0 OUTLIER -133.66 155.46 49.67 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.701 -178.054 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -124.38 -113.4 0.3 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.019 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -92.68 75.46 5.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.111 0.481 . . . . 0.0 110.688 -178.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.82 -39.12 3.09 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.748 178.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -89.74 167.22 13.05 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.671 0.272 . . . . 0.0 110.92 -178.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.402 HG11 ' HB3' ' A' ' 102' ' ' ARG . 2.5 m -124.0 160.99 27.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 121.356 0.598 . . . . 0.0 112.588 -173.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . 0.646 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 73.7 m-85 -139.32 -170.26 2.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.654 -1.157 . . . . 0.0 107.977 173.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.828 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 71.7 m80 -112.29 -155.06 0.56 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 173.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.403 ' H ' ' HB3' ' A' ' 109' ' ' HIS . 1.3 mm? -84.36 -25.31 29.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.139 0.495 . . . . 0.0 110.875 178.226 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.21 -32.84 16.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.084 -175.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.828 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -84.63 -16.34 42.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.655 -172.241 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -78.25 65.09 3.52 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.457 0.646 . . . . 0.0 110.624 179.239 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.707 HG23 ' HA ' ' A' ' 121' ' ' ARG . 12.1 p -121.35 164.52 16.93 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.892 -178.193 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.719 ' HB3' ' H ' ' A' ' 120' ' ' ASN . 41.3 t -60.24 152.74 24.02 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.203 172.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.97 -14.77 20.42 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.719 178.675 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.98 -50.94 4.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.594 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.561 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -106.63 -11.26 15.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.189 -178.35 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.617 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 61.61 36.2 16.85 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.592 -178.041 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . 0.719 ' H ' ' HB3' ' A' ' 115' ' ' CYS . 1.2 t30 -80.44 130.46 35.17 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 176.712 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.707 ' HA ' HG23 ' A' ' 114' ' ' THR . 1.6 ttp85 -76.29 117.83 18.37 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.887 0.375 . . . . 0.0 110.602 -177.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.4 mt -66.39 150.81 48.34 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.757 -177.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.469 HG11 ' N ' ' A' ' 124' ' ' PRO . 11.7 t -131.77 140.95 39.86 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.066 -171.489 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.469 ' N ' HG11 ' A' ' 123' ' ' VAL . 11.1 Cg_endo -56.21 111.03 0.66 Allowed 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.375 2.05 . . . . 0.0 111.074 172.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.33 -19.58 13.04 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 -174.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -100.76 167.5 10.27 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 2.2 mtm-85 -106.52 145.89 31.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.02 0.438 . . . . 0.0 111.776 -173.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -129.11 149.24 51.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.861 174.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 87.8 m-70 -117.06 109.26 16.75 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.535 -177.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.472 ' HA ' ' O ' ' A' ' 134' ' ' SER . 1.6 t80 -92.7 102.22 14.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.066 0.46 . . . . 0.0 109.846 178.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.525 HD12 HG13 ' A' ' 146' ' ' ILE . 12.0 mt -123.13 122.66 66.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.874 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 62.3 26.47 15.83 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.665 0.603 . . . . 0.0 111.086 178.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 78.28 34.19 37.51 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.229 -179.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.472 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.4 OUTLIER -139.0 152.73 47.88 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -177.859 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.3 mt -102.39 114.08 27.96 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.481 -174.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.511 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 64.9 m-85 -109.44 150.51 27.99 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 174.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . 0.472 ' HB3' ' HB2' ' A' ' 115' ' ' CYS . 11.4 p -114.47 176.13 5.18 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.393 -176.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -68.22 -17.53 64.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.308 -175.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -75.18 -45.94 37.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.114 -176.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.561 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 10.2 p-10 -93.17 -39.48 11.0 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.069 -177.646 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 24.24 84.86 0.12 Allowed Pre-proline 0 N--CA 1.477 0.911 0 O-C-N 124.507 1.13 . . . . 0.0 113.761 176.209 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.38 134.29 63.38 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.767 2.311 . . . . 0.0 112.879 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' THR . . . . . 0.517 ' O ' HG22 ' A' ' 143' ' ' THR . 1.6 m -104.7 -25.71 12.58 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.102 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -68.63 -50.78 48.69 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.899 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.08 102.09 5.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.63 178.184 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.525 HG13 HD12 ' A' ' 131' ' ' ILE . 2.3 tt -135.78 138.33 47.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.982 178.43 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -83.11 -18.63 38.87 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.068 0.461 . . . . 0.0 111.042 -178.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -139.48 -126.17 2.32 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 178.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 84.39 -36.67 2.92 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.815 -0.707 . . . . 0.0 113.282 174.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -79.74 -80.02 0.13 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.991 0.424 . . . . 0.0 111.269 -178.67 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . -84.24 103.52 2.61 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.208 -176.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 89.38 0.22 80.08 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.964 -0.636 . . . . 0.0 111.726 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 206' ' ' SER . . . . . 0.471 ' HB2' ' H ' ' A' ' 207' ' ' GLY . 0.7 OUTLIER 54.54 -107.34 0.37 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.09 0.556 . . . . 0.0 111.583 -177.464 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . 0.471 ' H ' ' HB2' ' A' ' 206' ' ' SER . . . -134.36 170.3 22.7 Favored Glycine 0 N--CA 1.448 -0.54 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 -178.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.22 140.92 38.91 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.036 0.446 . . . . 0.0 111.274 -175.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 26.7 mm -71.55 146.89 11.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 172.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . 0.42 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -48.28 117.53 5.85 Favored Pre-proline 0 C--N 1.33 -0.26 0 O-C-N 123.313 0.383 . . . . 0.0 110.509 176.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . 0.443 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 14.6 Cg_exo -69.85 8.13 0.86 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.748 2.965 . . . . 0.0 113.732 -172.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . 0.443 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 33.2 m-85 71.07 159.71 0.16 Allowed Pre-proline 0 C--O 1.234 0.252 0 O-C-N 123.76 0.663 . . . . 0.0 111.248 178.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.28 132.05 13.4 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.791 2.327 . . . . 0.0 111.787 175.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.32 177.25 7.83 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.823 178.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -85.89 142.27 28.98 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.271 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -103.4 -134.15 0.32 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.778 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 1.1 mm? -100.17 124.99 41.29 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 178.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 34.2 Cg_exo -58.79 150.67 69.59 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 123.077 2.518 . . . . 0.0 112.705 179.223 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 414' ' ' THR . . . . . 0.507 ' HA ' ' CB ' ' A' ' 84' ' ' SER . 0.3 OUTLIER -67.67 149.78 49.57 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.297 -178.261 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.1 m -54.01 113.82 1.37 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.362 0.601 . . . . 0.0 112.134 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -76.05 154.23 84.66 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.627 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -81.99 2.29 8.64 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.827 2.352 . . . . 0.0 112.997 178.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.86 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.302 -179.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.555 0 N-CA-C 111.901 -0.48 . . . . 0.0 111.901 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.76 -61.86 1.51 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.683 0.277 . . . . 0.0 111.461 -177.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -100.57 49.93 0.89 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.784 0.291 . . . . 0.0 111.784 -172.626 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.462 ' H ' HG13 ' A' ' 78' ' ' ILE . 0.0 OUTLIER -88.88 66.29 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.818 0.342 . . . . 0.0 110.731 179.403 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.668 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER -145.97 13.77 1.31 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.611 -177.697 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.772 ' HB3' ' HB1' ' A' ' 86' ' ' ALA . 0.4 OUTLIER -126.79 169.13 13.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.71 0.29 . . . . 0.0 110.982 -176.538 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 -88.34 114.23 24.75 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.214 -178.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.476 ' HA3' ' CB ' ' A' ' 415' ' ' SER . . . 102.54 -33.92 6.15 Favored Glycine 0 C--N 1.33 0.247 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 -177.113 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . 0.418 ' HA ' ' HG ' ' A' ' 80' ' ' LEU . 2.3 t30 67.22 83.82 0.16 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 172.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -139.68 -43.06 0.44 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.153 173.446 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . 0.477 ' O ' HG21 ' A' ' 414' ' ' THR . . . -167.76 140.33 6.18 Favored Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 111.114 -0.794 . . . . 0.0 111.114 178.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.772 ' HB1' ' HB3' ' A' ' 80' ' ' LEU . . . -141.18 164.91 28.98 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 117.005 0.403 . . . . 0.0 111.488 -174.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.668 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 37.7 t -65.41 144.49 57.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.357 176.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.82 -15.97 61.62 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.007 178.685 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -111.21 -59.35 1.98 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.636 -0.257 . . . . 0.0 111.257 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 10.5 m -74.32 -43.61 56.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.35 0.595 . . . . 0.0 110.729 -179.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.668 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 81.62 12.58 81.49 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.962 -176.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -75.99 148.29 38.19 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.867 0.365 . . . . 0.0 110.854 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.509 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -69.55 129.27 39.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.9 176.147 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.5 mt -94.05 108.75 37.65 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-O 120.963 0.411 . . . . 0.0 111.048 -178.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.683 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 9.5 Cg_exo -72.76 167.19 27.87 Favored 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.772 2.314 . . . . 0.0 111.673 175.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.767 ' HB1' ' HB3' ' A' ' 413' ' ' PRO . . . -74.96 -3.76 34.18 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.995 0.426 . . . . 0.0 111.383 -179.211 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.31 -4.03 30.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.654 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.683 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.3 OUTLIER -94.11 123.4 37.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.304 -174.462 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.6 mt -89.45 114.7 26.22 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 173.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.515 HG23 ' HB2' ' A' ' 411' ' ' ALA . 0.1 OUTLIER -115.82 141.9 31.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.275 -171.194 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.543 ' HE1' ' HD2' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -82.61 111.39 18.54 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.632 -177.623 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.427 ' H ' ' HG3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -111.52 127.4 55.7 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.104 -176.538 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -72.56 -39.15 67.68 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.067 0.461 . . . . 0.0 110.083 176.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.436 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 1.8 tp-100 -171.73 -100.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.656 -179.111 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.436 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -83.97 -17.98 64.16 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.934 -0.65 . . . . 0.0 111.724 177.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -101.99 149.4 24.27 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 9.7 p -122.7 148.45 26.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.221 -173.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -139.69 -170.25 2.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.656 177.08 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.758 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 69.1 m80 -114.17 -161.59 0.77 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 173.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.3 mp -85.35 -19.43 31.46 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.235 0.541 . . . . 0.0 111.037 179.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.491 ' HA ' ' NH1' ' A' ' 121' ' ' ARG . 0.0 OUTLIER -90.16 -38.41 13.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.436 -176.105 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.758 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.56 -28.29 56.21 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.366 -174.182 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . 0.543 ' HD2' ' HE1' ' A' ' 101' ' ' MET . 0.0 OUTLIER -71.45 82.23 0.79 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.038 -179.429 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.701 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.1 p -143.97 161.05 39.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.199 -176.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.564 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 1.7 t -67.62 142.23 56.5 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 173.59 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.98 -11.88 51.87 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.869 0.366 . . . . 0.0 111.091 -177.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.484 ' HB ' ' OD2' ' A' ' 140' ' ' ASP . 0.2 OUTLIER -91.62 -51.01 5.46 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -174.813 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.618 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 22.2 p -115.83 -7.42 12.05 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.886 0.374 . . . . 0.0 110.73 -178.245 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.564 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 70.99 27.4 3.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.981 -177.065 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . 0.618 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 3.7 t-20 -54.2 119.24 4.85 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.241 172.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.701 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.0 OUTLIER -69.39 108.24 3.65 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 177.277 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.678 HD22 ' HB2' ' A' ' 128' ' ' PHE . 40.4 mt -63.46 137.58 58.2 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -179.082 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 53.9 t -122.59 132.0 24.32 Favored Pre-proline 0 C--N 1.323 -0.573 0 C-N-CA 121.004 -0.279 . . . . 0.0 110.601 -172.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.44 110.88 0.78 Allowed 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.285 1.99 . . . . 0.0 110.638 173.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 110.45 -13.05 30.61 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.604 -175.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -108.0 172.43 6.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.762 0.315 . . . . 0.0 110.293 178.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.708 ' HB3' ' HB3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -79.15 138.24 37.81 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.056 -174.268 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.678 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -146.8 160.08 42.71 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.051 176.108 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . 0.592 ' HB3' HD13 ' A' ' 131' ' ' ILE . 8.3 m-70 -127.31 134.72 49.98 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.035 0.445 . . . . 0.0 111.035 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.558 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 12.9 t80 -124.22 103.21 8.11 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -179.783 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.592 HD13 ' HB3' ' A' ' 129' ' ' HIS . 0.0 OUTLIER -121.75 117.54 52.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.345 -179.635 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 52.7 t30 57.1 35.87 26.87 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.77 0.669 . . . . 0.0 110.842 177.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.558 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 75.21 35.53 48.42 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.617 -0.802 . . . . 0.0 113.109 179.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -130.75 139.17 50.23 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 117.126 0.463 . . . . 0.0 110.136 179.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 10.7 mt -94.55 116.14 28.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.081 0.467 . . . . 0.0 110.924 -177.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -125.69 159.76 31.43 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.307 177.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . 0.467 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 21.2 p -91.6 173.08 8.07 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 177.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.708 ' HB3' ' HB3' ' A' ' 127' ' ' ARG . 0.3 OUTLIER -74.76 -14.68 60.74 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 175.535 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . 0.467 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 15.4 t60 -84.46 -24.19 29.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.517 -177.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.484 ' OD2' ' HB ' ' A' ' 117' ' ' THR . 40.3 m-20 -120.77 17.88 11.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.349 -176.608 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 141' ' ' ARG . 4.5 ptm180 -53.67 120.81 24.42 Favored Pre-proline 0 C--O 1.235 0.305 0 CA-C-O 121.341 0.591 . . . . 0.0 111.307 -176.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 24.3 Cg_exo -64.13 128.99 23.01 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.908 2.405 . . . . 0.0 112.034 -179.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -98.06 -33.93 10.98 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.318 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -96.61 14.63 24.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.452 0.644 . . . . 0.0 110.471 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -146.0 55.93 1.18 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.603 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.471 HG12 ' HA2' ' A' ' 202' ' ' GLY . 7.0 tt -164.95 -35.85 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.39 -176.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 45.68 69.09 0.49 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.73 0.644 . . . . 0.0 110.95 -175.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 109.89 -98.81 1.14 Allowed Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 -175.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . 0.471 ' HA2' HG12 ' A' ' 146' ' ' ILE . . . -178.26 170.88 43.18 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.6 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 7.1 m -78.36 80.99 4.73 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 122.45 0.3 . . . . 0.0 110.331 176.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 81.24 -50.59 4.22 Favored Glycine 0 N--CA 1.452 -0.239 0 N-CA-C 111.562 -0.615 . . . . 0.0 111.562 -175.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -152.12 -179.19 27.54 Favored Glycine 0 N--CA 1.441 -1.032 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 177.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.58 74.36 9.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.145 0.498 . . . . 0.0 110.81 179.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 112.17 98.11 2.38 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.343 176.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -90.14 174.88 7.38 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 177.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 49.7 mm -104.62 136.16 39.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -61.37 124.2 79.66 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.764 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -57.14 150.85 54.49 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.885 2.39 . . . . 0.0 112.373 178.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -86.03 155.32 58.08 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.321 -174.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . 0.526 ' HA ' ' HA ' ' A' ' 101' ' ' MET . 64.6 Cg_endo -76.49 117.41 4.56 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.586 2.191 . . . . 0.0 112.054 175.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -127.44 166.86 17.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.792 -178.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -74.77 109.92 8.64 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 176.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . 0.515 ' HB2' HG23 ' A' ' 100' ' ' VAL . . . -89.83 -83.78 0.24 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.229 -174.361 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 412' ' ' LEU . 1.3 pt? -131.47 129.81 22.31 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.784 -176.034 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . 0.767 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 73.8 Cg_endo -80.68 121.18 4.08 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.509 2.139 . . . . 0.0 111.164 172.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 414' ' ' THR . . . . . 0.477 HG21 ' O ' ' A' ' 85' ' ' GLY . 32.4 p -93.47 -126.67 0.1 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -176.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 415' ' ' SER . . . . . 0.476 ' CB ' ' HA3' ' A' ' 82' ' ' GLY . 0.3 OUTLIER -90.37 173.11 8.29 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.017 0.437 . . . . 0.0 111.767 -176.428 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -104.93 141.15 21.96 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.558 -178.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -86.94 166.91 8.36 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.758 2.305 . . . . 0.0 113.092 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.981 0 CA-C-O 118.063 -0.97 . . . . 0.0 109.85 175.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.789 0 N-CA-C 112.268 -0.333 . . . . 0.0 112.268 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.32 -172.17 2.88 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 1.8 t80 66.92 79.13 0.24 Allowed 'General case' 0 C--N 1.331 -0.205 0 O-C-N 123.826 0.704 . . . . 0.0 111.606 175.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 1.1 mp -97.06 108.18 21.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.604 0.716 . . . . 0.0 110.223 177.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.571 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER -147.9 -1.34 0.59 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.189 176.059 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.79 109.3 9.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.707 179.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.403 ' O ' HG21 ' A' ' 414' ' ' THR . 57.3 m-85 -78.16 93.89 4.64 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.483 0.659 . . . . 0.0 110.462 -177.23 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.512 ' HA3' ' HA ' ' A' ' 415' ' ' SER . . . 123.45 -20.11 7.47 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.073 -175.236 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 64.14 18.94 11.55 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.548 0.739 . . . . 0.0 112.302 176.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.403 ' OG ' ' HA ' ' A' ' 414' ' ' THR . 0.2 OUTLIER -91.74 -14.09 30.52 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.848 176.947 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 151.43 170.14 17.92 Favored Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.001 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -167.93 163.81 13.83 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 178.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.572 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 43.3 t -68.5 145.78 53.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.058 0.456 . . . . 0.0 110.111 175.284 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -94.74 -1.71 52.44 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.793 179.11 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -112.41 -51.68 2.83 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.866 0.365 . . . . 0.0 110.338 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 34.8 m -77.78 -52.89 8.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.843 175.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.572 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 96.82 1.76 59.9 Favored Glycine 0 N--CA 1.443 -0.845 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.768 -176.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.6 134.88 34.38 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 177.433 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' SER . . . . . 0.54 ' HB3' HG22 ' A' ' 414' ' ' THR . 1.0 OUTLIER -65.69 148.3 51.98 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.16 176.735 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.8 mt -103.37 116.18 62.56 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -168.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -77.53 167.28 24.55 Favored 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.833 2.355 . . . . 0.0 111.028 170.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.08 7.27 6.41 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -176.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.67 -35.67 14.81 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -175.836 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -96.49 127.32 42.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.881 0.372 . . . . 0.0 110.785 -176.305 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.69 125.2 29.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.64 176.486 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.768 ' HB ' ' O ' ' A' ' 108' ' ' TYR . 29.8 m -115.91 -172.48 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.244 -170.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.692 ' HE3' ' HG3' ' A' ' 124' ' ' PRO . 3.8 mmt -122.59 112.7 18.31 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.005 0.431 . . . . 0.0 110.057 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -109.44 119.89 40.83 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.36 -178.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -96.63 -171.8 2.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.1 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.459 HE21 ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -79.58 63.88 4.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.367 0.603 . . . . 0.0 110.085 177.786 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 168.76 -102.32 0.18 Allowed Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.339 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -95.75 178.11 5.56 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.875 0.369 . . . . 0.0 110.729 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 9.6 p -123.76 143.46 36.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.221 0.534 . . . . 0.0 111.659 -174.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . 0.768 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 41.1 m-85 -127.76 -172.84 2.77 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 174.57 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.876 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 73.1 m80 -97.76 -164.53 1.15 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 172.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.6 pp -82.15 -23.57 35.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.895 0.379 . . . . 0.0 111.437 -178.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.56 -31.03 16.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.075 -175.343 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.876 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -78.79 -5.93 54.63 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.82 -176.342 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.33 76.6 1.86 Allowed 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.413 0.625 . . . . 0.0 110.5 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.729 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.7 OUTLIER -140.7 155.78 46.39 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.801 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' CYS . . . . . 0.507 ' HB2' ' N ' ' A' ' 119' ' ' ARG . 73.0 m -55.78 146.8 20.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.173 0.511 . . . . 0.0 111.369 175.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.73 -20.45 31.09 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.099 -179.586 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.3 -52.59 2.74 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.636 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 0.1 OUTLIER -94.56 -19.86 20.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.971 0.415 . . . . 0.0 111.08 -174.287 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.507 ' N ' ' HB2' ' A' ' 115' ' ' CYS . 4.9 mmt180 68.82 22.39 7.28 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.936 175.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ASN . . . . . 0.636 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 1.0 OUTLIER -63.9 130.23 43.26 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 171.725 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.729 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.6 OUTLIER -78.84 107.53 11.63 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.057 177.252 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.674 HD23 ' HA ' ' A' ' 128' ' ' PHE . 10.4 mt -63.99 139.73 58.8 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.441 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 3.0 t -121.86 132.36 24.25 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.436 -170.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.692 ' HG3' ' HE3' ' A' ' 101' ' ' MET . 40.0 Cg_exo -55.42 110.72 0.59 Allowed 'Trans proline' 0 N--CA 1.461 -0.431 0 C-N-CA 122.59 2.193 . . . . 0.0 111.288 179.132 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 110.81 -16.29 28.4 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.583 -177.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.487 ' O ' ' HA ' ' A' ' 404' ' ' ILE . 3.3 t70 -116.61 -153.36 0.53 Allowed 'General case' 0 C--N 1.326 -0.423 0 O-C-N 122.665 -0.315 . . . . 0.0 110.641 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.405 ' HD3' ' OE2' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -74.64 139.54 43.65 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -171.221 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.674 ' HA ' HD23 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -157.74 144.94 18.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.929 -1.032 . . . . 0.0 108.618 170.955 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' HIS . . . . . 0.478 ' CD2' ' HD2' ' A' ' 141' ' ' ARG . 8.3 m-70 -137.35 120.57 16.81 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.425 178.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.454 ' HD1' HD22 ' A' ' 135' ' ' LEU . 11.0 t80 -115.68 101.14 8.57 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 175.008 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -126.71 126.57 68.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.553 -178.099 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.2 t30 58.5 25.72 13.4 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.166 -178.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 78.57 36.38 29.92 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.388 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.564 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 0.5 OUTLIER -139.55 150.48 45.12 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -179.014 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.454 HD22 ' HD1' ' A' ' 130' ' ' TYR . 43.5 mt -104.22 123.61 47.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.741 0.305 . . . . 0.0 111.489 -174.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 0.564 ' CE2' ' HB2' ' A' ' 134' ' ' SER . 39.5 m-85 -138.17 178.52 7.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.383 -0.826 . . . . 0.0 108.863 176.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 28.4 p -130.78 -153.18 0.55 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.008 0.432 . . . . 0.0 109.953 174.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.405 ' OE2' ' HD3' ' A' ' 127' ' ' ARG . 1.5 tt0 -77.7 -27.29 50.68 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.458 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -84.17 -53.21 5.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.072 -171.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.55 ' CG ' ' HB3' ' A' ' 118' ' ' CYS . 3.4 p-10 -96.07 31.17 2.21 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.692 0.758 . . . . 0.0 110.741 -178.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.482 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 0.4 OUTLIER -62.29 126.3 87.54 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.855 179.828 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 3.0 Cg_exo -73.93 124.94 9.52 Favored 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.993 2.462 . . . . 0.0 112.205 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.34 53.13 2.69 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.353 0.597 . . . . 0.0 110.905 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -150.43 -77.04 0.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.233 -179.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.69 91.25 7.91 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.769 177.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 12.5 tt -123.71 -26.31 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.47 -178.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 32.7 m-20 67.68 -78.38 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.07 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -105.33 104.08 2.27 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.856 -0.687 . . . . 0.0 111.769 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -166.77 92.0 0.1 Allowed Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.61 -178.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 48.8 m -63.57 -53.67 48.03 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.472 0.654 . . . . 0.0 109.95 174.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . -148.22 -56.14 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.643 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 175.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -94.37 179.13 37.42 Favored Glycine 0 N--CA 1.439 -1.123 0 N-CA-C 110.404 -1.078 . . . . 0.0 110.404 167.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -152.14 92.32 1.7 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 117.046 0.423 . . . . 0.0 110.035 178.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -79.87 85.44 1.29 Allowed Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.051 -0.595 . . . . 0.0 113.14 -174.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 208' ' ' SER . . . . . 0.606 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 4.9 m -107.46 129.6 54.93 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 171.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 404' ' ' ILE . . . . . 0.487 ' HA ' ' O ' ' A' ' 126' ' ' ASP . 50.8 mm -109.81 129.85 63.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.787 -172.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 405' ' ' ALA . . . . . 0.45 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -64.69 134.14 95.93 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.969 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 406' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 5.6 Cg_exo -73.88 -176.48 2.62 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 123.011 2.474 . . . . 0.0 112.053 179.333 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -107.09 155.54 39.07 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.867 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -53.12 134.66 57.06 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.813 2.342 . . . . 0.0 112.846 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.19 175.71 9.33 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.162 -178.155 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -91.23 134.15 34.8 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.051 178.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 411' ' ' ALA . . . . . 0.454 ' HB1' ' CG2' ' A' ' 100' ' ' VAL . . . -83.51 178.73 7.88 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.417 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.9 tp -72.45 120.57 81.27 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 174.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -55.11 121.41 9.86 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.663 2.242 . . . . 0.0 112.06 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 414' ' ' THR . . . . . 0.54 HG22 ' HB3' ' A' ' 93' ' ' SER . 0.2 OUTLIER -82.34 162.17 22.31 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.546 179.821 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 415' ' ' SER . . . . . 0.512 ' HA ' ' HA3' ' A' ' 82' ' ' GLY . 24.2 m 71.44 -174.8 0.17 Allowed 'General case' 0 CA--C 1.529 0.169 0 O-C-N 123.753 0.658 . . . . 0.0 110.058 -174.489 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -126.27 87.75 55.63 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -70.45 136.56 31.45 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.791 2.328 . . . . 0.0 111.881 -178.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.274 -0.87 . . . . 0.0 110.085 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.782 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 9.3 ptt-85 . . . . . 0 N--CA 1.457 -0.122 0 CA-C-O 121.408 0.623 . . . . 0.0 109.691 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.949 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -94.5 46.73 1.15 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.535 -171.527 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 51.0 35.35 12.52 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 121.498 0.666 . . . . 0.0 110.874 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 121.38 -129.2 7.64 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 -173.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.589 ' HA ' HD12 ' A' ' 80' ' ' LEU . 64.6 t30 -142.74 79.84 1.67 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.128 0.49 . . . . 0.0 111.462 175.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.29 -55.48 2.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.947 174.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 177.79 144.35 5.42 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.822 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.949 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -160.51 158.79 29.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.642 0.221 . . . . 0.0 110.836 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.833 ' HB2' ' HA ' ' A' ' 108' ' ' TYR . 0.1 OUTLIER -86.83 145.76 26.48 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.982 178.474 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.2 -12.54 60.91 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.088 -0.383 . . . . 0.0 111.714 -178.398 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.527 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -82.86 -47.87 11.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.586 0.231 . . . . 0.0 110.718 -177.495 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 2.6 p -126.84 -42.87 1.73 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.753 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.782 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 75.19 15.74 80.97 Favored Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.842 -0.617 . . . . 0.0 113.682 179.158 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.3 76.0 8.25 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 117.184 0.492 . . . . 0.0 111.687 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.499 ' HA ' HG21 ' A' ' 414' ' ' THR . 0.7 OUTLIER 62.43 128.67 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 O-C-N 124.228 0.955 . . . . 0.0 113.458 172.765 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.686 HD13 HG11 ' A' ' 100' ' ' VAL . 1.3 mt -103.82 99.51 16.46 Favored Pre-proline 0 C--N 1.32 -0.69 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 170.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.452 ' HD3' ' O ' ' A' ' 93' ' ' SER . 5.4 Cg_exo -78.54 159.17 28.84 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.175 2.583 . . . . 0.0 112.103 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.95 -16.89 56.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.372 0.606 . . . . 0.0 109.674 174.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.1 -35.25 31.9 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.965 -178.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -100.74 118.45 36.86 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.452 ' O ' HD23 ' A' ' 110' ' ' LEU . 1.9 mt -68.78 139.4 55.28 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.66 -179.023 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.686 HG11 HD13 ' A' ' 94' ' ' ILE . 2.7 m -117.74 148.75 20.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.284 0.564 . . . . 0.0 111.38 -176.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.7 115.85 27.38 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.994 -177.302 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 18.6 ptt180 -112.04 135.46 52.65 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.333 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -113.67 -122.59 0.29 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.201 -177.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.23 -54.13 48.04 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.071 0.462 . . . . 0.0 111.506 -176.606 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -162.1 31.83 0.32 Allowed Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -140.56 158.77 43.5 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -177.198 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -120.53 139.76 46.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.691 -176.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' TYR . . . . . 0.833 ' HA ' ' HB2' ' A' ' 87' ' ' CYS . 74.5 m-85 -137.46 160.34 39.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.36 178.106 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.787 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 29.0 m80 -85.84 152.2 23.19 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.508 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.452 HD23 ' O ' ' A' ' 99' ' ' LEU . 1.5 pp -65.86 -21.17 66.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.0 0.428 . . . . 0.0 111.045 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.428 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.86 -23.47 21.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.196 0.522 . . . . 0.0 110.335 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.787 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 12.4 m -94.2 -2.3 52.73 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.331 -178.362 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' PHE . . . . . 0.602 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.0 OUTLIER -76.62 74.75 3.31 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.229 0.538 . . . . 0.0 110.33 177.127 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.482 HG22 ' HA ' ' A' ' 121' ' ' ARG . 2.2 p -130.6 154.26 48.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.06 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.565 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 17.0 p -72.56 150.91 42.73 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.099 0.476 . . . . 0.0 110.273 177.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.05 2.0 52.92 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.478 -177.041 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.62 -50.78 3.34 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -176.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.64 -2.78 10.92 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.841 0.353 . . . . 0.0 110.93 -177.377 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 62.24 41.15 10.78 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.782 -179.383 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -89.44 128.78 35.99 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.13 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.482 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.0 OUTLIER -72.45 126.76 30.63 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.826 0.345 . . . . 0.0 110.316 -177.894 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.794 HD22 ' HB2' ' A' ' 128' ' ' PHE . 0.7 OUTLIER -80.86 132.88 35.5 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.564 179.625 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -127.24 139.28 34.7 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.789 -173.094 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.98 110.93 0.75 Allowed 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.213 1.942 . . . . 0.0 110.612 171.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 112.65 -5.83 26.16 Favored Glycine 0 N--CA 1.447 -0.586 0 N-CA-C 111.26 -0.736 . . . . 0.0 111.26 -174.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -117.52 165.7 13.24 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 176.026 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 2.0 mtm-85 -93.81 131.32 39.29 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.122 0.487 . . . . 0.0 111.348 -174.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.794 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -138.63 171.84 13.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.22 -179.386 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 129' ' ' HIS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 86.1 m-70 -131.94 133.77 44.9 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.786 0.327 . . . . 0.0 110.776 178.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.487 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 69.2 t80 -125.47 101.61 7.01 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 1.5 mt -129.83 128.92 65.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.432 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 63.93 18.28 11.09 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 123.515 0.509 . . . . 0.0 110.992 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.487 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 81.82 30.52 35.28 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.225 -176.458 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.484 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.9 OUTLIER -126.13 155.33 41.84 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 -176.894 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.608 ' HB3' HD11 ' A' ' 122' ' ' LEU . 12.2 mt -108.21 123.7 49.16 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.161 0.505 . . . . 0.0 111.286 -174.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.645 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 22.1 m-85 -129.71 174.9 9.27 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 174.31 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 10.4 p -127.62 -175.82 3.58 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.457 0.646 . . . . 0.0 111.589 -174.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.475 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -72.77 -25.52 61.2 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.279 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 47.4 t60 -76.9 -39.2 51.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.769 -175.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.486 ' OD1' ' HB3' ' A' ' 136' ' ' PHE . 1.7 p30 -85.28 -58.77 2.55 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.364 178.796 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ARG . . . . . 0.408 ' N ' ' OD1' ' A' ' 140' ' ' ASP . 0.4 OUTLIER 55.27 72.29 1.09 Allowed Pre-proline 0 C--N 1.327 -0.397 0 C-N-CA 123.146 0.579 . . . . 0.0 111.971 174.019 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.0 99.51 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.39 2.06 . . . . 0.0 111.866 176.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -92.56 -21.25 20.2 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.53 -171.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -68.32 -24.41 64.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.601 -178.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -141.25 60.23 1.51 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.062 0.458 . . . . 0.0 111.253 -178.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.322 -0.6 0 CA-C-O 121.592 0.711 . . . . 0.0 110.102 176.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.453 0 N-CA-C 112.684 -0.166 . . . . 0.0 112.684 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.23 130.33 36.37 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.855 0.359 . . . . 0.0 110.755 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 35.7 mm -120.15 137.47 53.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.912 -176.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 405' ' ' ALA . . . . . 0.499 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -61.82 133.57 93.77 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.479 -177.365 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 406' ' ' PRO . . . . . 0.602 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 15.2 Cg_exo -68.69 172.48 11.51 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.111 2.541 . . . . 0.0 112.401 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -97.1 158.1 33.87 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.144 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 408' ' ' PRO . . . . . 0.416 ' HB2' ' HB2' ' A' ' 99' ' ' LEU . 14.2 Cg_endo -88.91 128.63 1.97 Allowed 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.762 2.308 . . . . 0.0 112.976 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -130.73 163.03 28.16 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -77.29 127.98 33.54 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 122.088 -0.383 . . . . 0.0 110.371 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -105.75 -84.29 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.56 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.423 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.4 OUTLIER -131.53 144.27 52.69 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.046 -176.118 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 413' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 5.6 Cg_exo -79.38 147.04 19.98 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.886 2.391 . . . . 0.0 111.037 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.499 HG21 ' HA ' ' A' ' 93' ' ' SER . 0.2 OUTLIER -86.55 147.62 25.87 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.831 0.348 . . . . 0.0 111.2 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 12.5 m . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.68 177.898 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.538 ' HE ' ' HA2' ' A' ' 91' ' ' GLY . 19.9 ptt180 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.983 0.42 . . . . 0.0 110.613 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.495 HD22 ' HB2' ' A' ' 86' ' ' ALA . 0.9 OUTLIER -113.08 -174.72 2.51 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.89 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -77.73 -35.97 51.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.96 0.409 . . . . 0.0 110.921 -177.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -116.34 -129.53 4.41 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 177.149 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 18.6 p30 -147.01 22.56 1.22 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.211 0.529 . . . . 0.0 110.356 175.038 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.87 -58.78 3.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.115 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 93' ' ' SER . . . -170.16 146.78 10.16 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 111.519 -0.633 . . . . 0.0 111.519 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.495 ' HB2' HD22 ' A' ' 80' ' ' LEU . . . -129.06 141.83 51.09 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.771 0.319 . . . . 0.0 110.986 -177.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.736 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 41.9 t -62.38 145.84 52.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.137 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.41 -25.42 42.09 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.611 176.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -96.0 -47.95 5.89 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.139 -177.094 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 56.0 m -83.06 -62.66 1.54 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.254 0.55 . . . . 0.0 110.244 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.736 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 118.19 -19.39 10.92 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.426 -175.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -78.11 177.38 8.38 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.937 0.399 . . . . 0.0 110.922 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 0.5 OUTLIER -84.76 173.82 10.38 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.699 -174.69 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.463 HG12 HG11 ' A' ' 100' ' ' VAL . 2.3 mp -110.38 110.36 58.08 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.862 177.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.4 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 3.1 Cg_exo -78.22 161.49 29.09 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 123.106 2.538 . . . . 0.0 112.127 177.577 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.19 -16.65 57.68 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.209 0.528 . . . . 0.0 110.987 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -93.8 -21.41 19.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.163 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.4 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 1.0 OUTLIER -101.04 108.61 20.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.216 0.531 . . . . 0.0 110.064 -179.514 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 14.2 mt -66.96 131.53 46.06 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.249 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.699 ' HB ' ' O ' ' A' ' 108' ' ' TYR . 17.3 m -117.36 166.95 11.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.995 -175.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.9 111.96 20.39 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.436 ' H ' ' HG3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -110.7 139.84 45.61 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.627 -175.914 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -119.78 -165.11 1.13 Allowed 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.134 179.081 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.01 87.19 7.38 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.909 0.385 . . . . 0.0 110.543 -178.397 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 140.82 -48.03 0.84 Allowed Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.47 176.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -142.59 175.73 9.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.599 0.237 . . . . 0.0 110.383 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 5.0 p -132.6 141.01 46.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.881 -176.004 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' TYR . . . . . 0.699 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 1.4 m-85 -120.18 -173.87 2.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.193 175.515 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.773 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 74.7 m80 -103.91 -157.67 0.62 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 177.044 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.45 HD12 ' HB3' ' A' ' 408' ' ' PRO . 0.3 OUTLIER -86.53 -22.29 26.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.008 176.248 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.84 -36.02 15.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.611 -174.069 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.773 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.62 -17.72 59.02 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.531 -174.989 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.87 85.35 0.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.766 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.49 HG23 ' HD2' ' A' ' 121' ' ' ARG . 0.6 OUTLIER -143.09 158.44 43.6 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.653 -178.42 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.47 ' HB3' ' H ' ' A' ' 120' ' ' ASN . 42.2 t -62.1 149.76 40.35 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.878 0.37 . . . . 0.0 110.182 175.124 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 3.5 m -92.68 -14.09 28.54 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.092 0.472 . . . . 0.0 110.579 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.79 -49.6 4.31 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.032 -178.386 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.09 4.58 13.69 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -174.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 63.9 13.2 7.4 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.466 0.707 . . . . 0.0 112.708 175.062 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ASN . . . . . 0.47 ' H ' ' HB3' ' A' ' 115' ' ' CYS . 6.0 t-20 -63.66 123.86 19.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.816 -178.452 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.49 ' HD2' HG23 ' A' ' 114' ' ' THR . 0.7 OUTLIER -73.31 116.31 13.71 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.982 0.42 . . . . 0.0 110.894 179.282 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.596 HD22 ' HB2' ' A' ' 128' ' ' PHE . 0.7 OUTLIER -75.04 154.51 37.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.126 -179.506 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.496 HG23 ' CB ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -142.54 146.76 40.03 Favored Pre-proline 0 C--N 1.327 -0.402 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.868 -170.015 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -68.06 111.83 2.56 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.823 2.348 . . . . 0.0 111.768 175.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 113.85 -9.36 23.44 Favored Glycine 0 N--CA 1.448 -0.528 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 -177.27 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.496 ' CB ' HG23 ' A' ' 123' ' ' VAL . 6.4 t70 -105.42 -145.12 0.38 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 173.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.532 ' HD2' ' OE2' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -133.53 146.7 51.29 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.029 0.442 . . . . 0.0 110.992 179.127 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.596 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -143.1 145.4 32.82 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.458 178.148 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -109.39 126.39 53.38 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.108 0.48 . . . . 0.0 110.518 -178.188 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.449 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 4.6 t80 -124.2 101.5 7.23 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.509 HG21 ' HB3' ' A' ' 145' ' ' LEU . 0.5 OUTLIER -122.46 115.56 46.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.253 -178.709 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 12.1 t30 59.65 42.64 16.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.753 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.449 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 67.52 35.83 87.35 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.792 177.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 14.9 m -133.5 135.89 44.73 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 122.606 -0.35 . . . . 0.0 110.121 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 20.6 mt -89.48 120.94 31.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.93 -177.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 -130.11 167.84 17.71 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.442 177.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' CYS . . . . . 0.411 ' HB3' ' HB2' ' A' ' 115' ' ' CYS . 4.5 p -132.47 -169.44 2.23 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.076 0.465 . . . . 0.0 111.35 -177.834 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.532 ' OE2' ' HD2' ' A' ' 127' ' ' ARG . 5.1 mm-40 -72.69 -31.01 64.72 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.572 -173.308 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -66.24 -43.72 85.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.36 -173.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.466 ' OD2' ' HD3' ' A' ' 142' ' ' PRO . 14.9 p-10 -91.38 -49.85 6.12 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.733 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 41.73 69.56 2.04 Favored Pre-proline 0 N--CA 1.47 0.563 0 O-C-N 123.641 0.588 . . . . 0.0 111.543 178.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' PRO . . . . . 0.466 ' HD3' ' OD2' ' A' ' 140' ' ' ASP . 32.0 Cg_endo -62.55 92.67 0.14 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.134 2.556 . . . . 0.0 112.756 -174.164 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.98 6.87 5.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.728 -175.273 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -87.03 -12.0 48.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.915 172.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.509 ' HB3' HG21 ' A' ' 131' ' ' ILE . 0.5 OUTLIER -110.62 -50.64 2.94 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.321 178.61 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.417 ' H ' HG13 ' A' ' 146' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.208 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.274 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.442 0 N-CA-C 112.309 -0.316 . . . . 0.0 112.309 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.5 172.13 13.15 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -178.614 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 26.5 mm -84.42 -76.03 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.021 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 405' ' ' ALA . . . . . 0.4 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . 179.34 151.67 0.52 Allowed Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.616 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 406' ' ' PRO . . . . . 0.405 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 15.9 Cg_exo -68.92 -16.27 40.95 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.215 1.943 . . . . 0.0 110.649 172.314 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 407' ' ' PHE . . . . . 0.405 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 2.6 m-85 74.15 145.8 0.11 Allowed Pre-proline 0 C--N 1.34 0.158 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.214 177.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 408' ' ' PRO . . . . . 0.45 ' HB3' HD12 ' A' ' 110' ' ' LEU . 37.9 Cg_endo -67.23 115.32 3.6 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.306 2.004 . . . . 0.0 111.76 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -134.4 175.08 9.84 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.689 -177.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -100.32 135.58 41.54 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 411' ' ' ALA . . . . . 0.427 ' HB3' HG21 ' A' ' 94' ' ' ILE . . . -85.97 -102.99 0.06 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 175.094 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' A' ' 412' ' ' LEU . 17.2 mt -132.3 139.89 36.26 Favored Pre-proline 0 C--N 1.321 -0.655 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 174.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -53.75 133.46 54.32 Favored 'Trans proline' 0 C--O 1.236 0.388 0 C-N-CA 122.783 2.322 . . . . 0.0 112.218 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 5.7 m -58.33 141.39 51.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.518 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.346 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 171.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.641 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.311 0 CA-C-O 121.066 0.46 . . . . 0.0 110.637 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.569 HD11 ' H ' ' A' ' 84' ' ' SER . 0.4 OUTLIER -108.13 -178.97 3.76 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.035 -174.213 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -80.66 81.65 6.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.727 175.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 114.27 -134.56 11.83 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.774 -0.727 . . . . 0.0 111.315 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.432 ' HA ' HD21 ' A' ' 80' ' ' LEU . 53.1 p-10 -152.29 35.33 0.52 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.125 0.488 . . . . 0.0 110.822 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.569 ' H ' HD11 ' A' ' 80' ' ' LEU . 0.3 OUTLIER -106.62 -113.69 0.27 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.058 -179.613 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLY . . . . . 0.521 ' H ' ' HB2' ' A' ' 84' ' ' SER . . . -88.08 124.76 7.32 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.81 -176.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.447 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -140.16 160.53 39.75 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 177.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.87 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 42.2 t -78.55 145.17 34.98 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.432 0.634 . . . . 0.0 111.288 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.02 -11.51 50.19 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.935 177.231 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -107.58 -50.36 3.08 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.938 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 28.1 m -82.48 -54.36 5.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.449 0.643 . . . . 0.0 109.736 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.87 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 102.56 -10.37 56.13 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.153 -173.816 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.05 146.4 52.68 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 176.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.64 144.31 57.02 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.04 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.518 HG12 HG11 ' A' ' 100' ' ' VAL . 5.7 mt -93.72 118.6 67.44 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.237 178.723 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 94' ' ' ILE . 3.0 Cg_exo -77.21 144.56 23.51 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.998 2.465 . . . . 0.0 112.181 178.156 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.535 ' HB2' ' HB3' ' A' ' 413' ' ' PRO . . . -77.42 -6.34 53.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.2 0.524 . . . . 0.0 110.604 178.403 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.41 16.98 25.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.676 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -131.98 162.84 29.73 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.121 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' A' ' 409' ' ' GLU . 6.3 mt -106.69 116.06 31.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.167 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.518 HG11 HG12 ' A' ' 94' ' ' ILE . 4.5 m -119.37 150.82 21.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.156 -174.405 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.506 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -92.51 152.88 19.41 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.316 179.764 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.447 ' HB3' HG12 ' A' ' 107' ' ' VAL . 0.0 OUTLIER -153.9 159.78 41.89 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.855 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -122.4 -162.28 0.99 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.553 -178.167 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.72 12.08 2.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.163 -178.654 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -137.34 -81.3 0.1 OUTLIER Glycine 0 N--CA 1.442 -0.935 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.526 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -106.52 175.44 5.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.8 0.333 . . . . 0.0 111.754 -174.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.447 HG12 ' HB3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -108.31 149.83 11.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.126 -177.57 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 108' ' ' TYR . . . . . 0.492 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 32.2 m-85 -141.77 -168.72 2.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.254 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.76 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 74.6 m80 -110.58 -157.42 0.61 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 172.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -86.17 -23.17 26.63 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.907 0.384 . . . . 0.0 111.266 176.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.41 -36.99 15.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.791 -174.07 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.76 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -74.58 -13.06 60.61 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.234 -174.375 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -79.23 64.2 4.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.33 0.586 . . . . 0.0 109.996 175.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -125.17 154.88 40.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.483 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.425 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 12.5 t -62.91 135.93 57.57 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.258 0.552 . . . . 0.0 110.68 176.407 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 2.4 m -81.88 -17.5 47.06 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.697 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.32 -51.34 4.63 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -176.724 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 14.6 p -114.14 -7.09 13.05 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.379 -174.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.425 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 76.76 13.01 2.32 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.001 176.662 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -63.68 118.36 8.16 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 174.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.01 122.68 17.93 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 177.374 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.7 HD13 ' HD2' ' A' ' 128' ' ' PHE . 11.4 mt -68.08 127.22 32.08 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.339 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.5 ' HB ' ' CB ' ' A' ' 126' ' ' ASP . 71.0 t -107.61 134.12 20.14 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -172.525 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -55.82 109.95 0.49 Allowed 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 122.032 1.821 . . . . 0.0 111.018 175.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.37 6.5 56.58 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.507 -175.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.5 ' CB ' ' HB ' ' A' ' 123' ' ' VAL . 27.3 t0 -121.89 173.94 7.19 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 122.643 -0.328 . . . . 0.0 110.566 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.577 ' HB2' ' HG3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -65.34 140.82 58.7 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.22 0.533 . . . . 0.0 112.335 -176.569 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.7 ' HD2' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -156.64 170.26 22.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.404 -0.817 . . . . 0.0 108.844 177.516 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -146.16 137.48 24.66 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.692 0.282 . . . . 0.0 110.683 176.7 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -125.03 100.92 6.8 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.77 HG21 HG23 ' A' ' 146' ' ' ILE . 7.1 mm -120.13 104.35 15.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.147 -177.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.1 t30 56.54 55.83 6.13 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.545 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 63.9 33.08 86.28 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.36 -0.837 . . . . 0.0 113.243 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.438 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 1.2 m -131.84 132.83 44.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -178.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.524 ' HB3' HD11 ' A' ' 122' ' ' LEU . 38.2 mt -91.88 116.98 29.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.345 0.593 . . . . 0.0 111.107 -177.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.438 ' CE2' ' HB2' ' A' ' 134' ' ' SER . 61.4 m-85 -128.18 -179.47 5.02 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.238 -0.892 . . . . 0.0 108.712 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' CYS . . . . . 0.721 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 10.3 p -129.25 -178.91 4.85 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.036 0.446 . . . . 0.0 110.659 176.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.577 ' HG3' ' HB2' ' A' ' 127' ' ' ARG . 1.4 mm-40 -79.13 -14.19 59.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.387 179.073 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' HIS . . . . . 0.721 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 71.2 t60 -70.97 -47.22 60.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.26 0.552 . . . . 0.0 109.643 -178.458 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.52 29.73 5.9 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.571 175.401 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ARG . . . . . 0.437 HH11 ' HD3' ' A' ' 141' ' ' ARG . 14.5 ttp180 -22.64 99.22 0.06 OUTLIER Pre-proline 0 N--CA 1.474 0.725 0 C-N-CA 125.812 1.645 . . . . 0.0 113.9 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' PRO . . . . . 0.413 ' HG3' ' CG ' ' A' ' 136' ' ' PHE . 46.4 Cg_endo -97.55 73.31 0.09 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.449 2.766 . . . . 0.0 112.989 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.41 169.98 8.43 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.142 -0.349 . . . . 0.0 111.247 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . 65.66 -84.21 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.484 0.714 . . . . 0.0 111.206 178.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -93.05 20.82 6.36 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 176.205 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.77 HG23 HG21 ' A' ' 131' ' ' ILE . 5.7 mt . . . . . 0 C--O 1.233 0.204 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.738 -171.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.486 0 N-CA-C 114.385 0.514 . . . . 0.0 114.385 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 208' ' ' SER . . . . . 0.64 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 68.7 m -156.45 138.3 14.33 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 171.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 46.5 mm -118.89 137.08 54.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.539 0.209 . . . . 0.0 110.576 -174.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 405' ' ' ALA . . . . . 0.476 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -75.23 134.48 73.87 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.125 -178.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 406' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 14.7 Cg_exo -70.3 -178.67 2.67 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 123.482 2.788 . . . . 0.0 112.458 177.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -97.95 157.92 33.75 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.333 -177.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 408' ' ' PRO . . . . . 0.448 ' HB3' ' SD ' ' A' ' 101' ' ' MET . 97.1 Cg_endo -87.51 121.04 1.55 Allowed 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.719 2.279 . . . . 0.0 112.054 172.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 409' ' ' GLU . . . . . 0.409 ' HA ' HD22 ' A' ' 99' ' ' LEU . 0.0 OUTLIER -137.99 178.08 7.39 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.297 178.043 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -62.25 149.75 41.02 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.095 0.474 . . . . 0.0 111.458 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -136.32 -145.23 0.21 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.575 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 4.4 tp -73.01 128.18 88.3 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.733 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 413' ' ' PRO . . . . . 0.535 ' HB3' ' HB2' ' A' ' 96' ' ' ALA . 9.9 Cg_exo -72.17 168.96 22.67 Favored 'Trans proline' 0 CA--C 1.532 0.4 0 C-N-CA 123.095 2.53 . . . . 0.0 113.668 -175.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 90.8 m -92.49 133.08 36.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.594 178.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 69.4 m . . . . . 0 CA--C 1.533 0.294 0 O-C-N 123.329 0.393 . . . . 0.0 111.255 179.576 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.804 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 39.1 ttp180 . . . . . 0 CA--C 1.518 -0.254 0 CA-C-O 121.481 0.657 . . . . 0.0 110.784 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.47 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -82.15 127.02 32.72 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.348 178.13 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -66.83 105.17 1.51 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.471 ' O ' ' HB2' ' A' ' 83' ' ' ASN . . . 94.93 -94.26 1.73 Allowed Glycine 0 N--CA 1.442 -0.964 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 -172.583 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 5.0 t-20 170.24 167.48 0.06 Allowed 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 177.051 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.7 m 71.03 -60.94 0.5 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 172.058 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLY . . . . . 0.401 ' O ' ' HA ' ' A' ' 93' ' ' SER . . . -79.69 71.86 2.64 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.37 -172.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.47 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -148.18 170.78 17.11 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 122.293 0.237 . . . . 0.0 110.381 179.305 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.81 145.78 30.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.999 0.428 . . . . 0.0 110.231 -179.082 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.37 -8.31 55.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.542 -172.568 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.711 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -88.65 -54.11 4.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.642 0.258 . . . . 0.0 111.453 -176.187 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 31.5 p -98.28 -39.84 8.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.063 0.459 . . . . 0.0 110.509 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.804 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 96.77 8.74 56.91 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-N 115.652 -0.703 . . . . 0.0 112.223 -178.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -89.24 155.62 19.28 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.781 0.324 . . . . 0.0 110.321 177.13 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.509 ' HB3' ' HB ' ' A' ' 414' ' ' THR . 13.9 m -71.39 160.27 33.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.472 -174.082 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 23.3 mt -101.14 111.23 63.2 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.219 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.73 148.0 22.31 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 123.021 2.481 . . . . 0.0 111.3 172.02 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.94 -11.78 61.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.037 0.446 . . . . 0.0 111.594 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.85 1.0 57.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.26 0.552 . . . . 0.0 110.797 179.053 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.07 175.38 5.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.912 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.648 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 32.0 mt -124.11 133.17 53.67 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.694 0.283 . . . . 0.0 110.337 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -115.96 142.29 29.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.364 0.602 . . . . 0.0 110.6 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 5.1 mmt -85.56 113.98 22.22 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.788 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -99.44 121.93 41.83 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.203 -178.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -104.71 -83.34 0.5 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.769 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -123.64 60.2 1.1 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.24 0.543 . . . . 0.0 110.279 -179.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.65 -17.37 45.12 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.105 -179.091 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -92.38 157.94 16.34 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 177.605 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -131.81 144.01 38.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.994 0.426 . . . . 0.0 111.745 -175.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' TYR . . . . . 0.409 ' HD1' ' HB2' ' A' ' 89' ' ' ALA . 92.9 m-85 -138.7 165.96 25.61 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 175.12 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.832 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 30.6 m80 -87.44 168.92 12.68 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.482 178.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' A' ' 110' ' ' LEU . 0.4 OUTLIER -62.58 -31.22 72.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.247 0.546 . . . . 0.0 110.983 177.906 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.459 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.48 -20.78 23.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.905 179.388 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.832 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 35.3 m -91.27 -4.13 56.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.624 -174.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' PHE . . . . . 0.557 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.1 OUTLIER -85.16 91.83 8.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.952 0.406 . . . . 0.0 110.553 178.025 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.595 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.7 OUTLIER -146.43 156.19 43.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.237 -177.288 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.549 ' HB2' ' HB3' ' A' ' 137' ' ' CYS . 0.0 OUTLIER -70.82 152.64 43.52 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 169.501 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 1.4 p -93.21 -22.01 19.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -174.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.2 -51.05 4.56 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -172.498 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.701 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -101.57 -8.69 21.65 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.522 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.4 OUTLIER 62.78 44.75 6.21 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.429 -179.772 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ASN . . . . . 0.492 ' H ' ' HB3' ' A' ' 115' ' ' CYS . 44.3 t30 -80.44 118.55 22.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.597 176.468 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.595 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.9 OUTLIER -69.58 108.04 3.66 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 177.719 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.441 ' H ' ' HG ' ' A' ' 122' ' ' LEU . 0.6 OUTLIER -70.8 129.06 38.11 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.688 -179.669 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.2 t -145.26 146.71 31.37 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.778 -173.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.79 111.69 0.76 Allowed 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.63 2.22 . . . . 0.0 111.635 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.22 -19.77 13.09 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.338 -0.705 . . . . 0.0 111.338 -176.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.423 ' CG ' ' H ' ' A' ' 127' ' ' ARG . 9.6 t70 -101.93 -152.82 0.44 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.233 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.423 ' H ' ' CG ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -121.56 155.19 35.55 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.765 0.317 . . . . 0.0 110.815 -174.2 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.546 ' CE2' ' HB2' ' A' ' 130' ' ' TYR . 0.2 OUTLIER -157.61 143.31 17.31 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.655 174.3 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 129' ' ' HIS . . . . . 0.466 ' HE2' ' CD ' ' A' ' 138' ' ' GLU . 51.7 m-70 -121.33 122.81 40.67 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.831 0.348 . . . . 0.0 110.078 178.288 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.546 ' HB2' ' CE2' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -119.82 101.77 8.11 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 178.813 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.646 HD11 HD12 ' A' ' 146' ' ' ILE . 1.5 mt -108.52 103.21 15.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.13 -178.027 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.1 t30 58.17 28.5 16.58 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.803 177.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.409 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 92.75 30.17 9.93 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.775 -179.45 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -125.9 126.63 44.72 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 176.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.427 HD22 ' CD1' ' A' ' 122' ' ' LEU . 14.6 mt -91.66 115.7 28.27 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -174.637 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -136.38 179.01 6.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.461 176.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' CYS . . . . . 0.652 ' SG ' ' HB2' ' A' ' 139' ' ' HIS . 1.1 p -137.84 179.19 6.57 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.719 0.295 . . . . 0.0 110.792 176.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.466 ' CD ' ' HE2' ' A' ' 129' ' ' HIS . 6.8 mm-40 -73.72 -16.07 61.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.284 -176.343 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' HIS . . . . . 0.652 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 0.2 OUTLIER -78.43 -11.07 59.93 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.698 0.285 . . . . 0.0 110.885 -176.644 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.701 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 10.4 p-10 -127.82 -47.37 1.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.225 177.434 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ARG . . . . . 0.408 ' HD3' HG21 ' A' ' 146' ' ' ILE . 0.0 OUTLIER 46.77 68.43 3.47 Favored Pre-proline 0 N--CA 1.47 0.569 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 172.89 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 142' ' ' PRO . . . . . 0.44 ' HD3' ' OD2' ' A' ' 140' ' ' ASP . 66.1 Cg_endo -94.6 -172.99 0.29 Allowed 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 122.884 2.389 . . . . 0.0 112.837 178.607 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' THR . . . . . 0.421 ' C ' ' H ' ' A' ' 145' ' ' LEU . 5.8 m 75.26 121.83 0.04 OUTLIER 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.226 -176.525 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -75.5 39.95 0.17 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.148 0.499 . . . . 0.0 111.023 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.421 ' H ' ' C ' ' A' ' 143' ' ' THR . 1.9 mt -162.69 27.06 0.1 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.093 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.646 HD12 HD11 ' A' ' 131' ' ' ILE . 3.0 tt . . . . . 0 C--N 1.327 -0.384 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.088 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.465 0 N-CA-C 111.897 -0.481 . . . . 0.0 111.897 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 40.6 m -155.52 136.16 13.42 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.941 0.4 . . . . 0.0 110.582 177.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 15.0 mm -93.85 136.16 26.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.232 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 405' ' ' ALA . . . . . 0.47 ' HA ' ' CD1' ' A' ' 128' ' ' PHE . . . -60.72 143.0 91.41 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.311 -178.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 406' ' ' PRO . . . . . 0.557 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 71.9 Cg_endo -74.68 -164.35 0.22 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.723 2.282 . . . . 0.0 112.541 179.234 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -117.07 146.07 37.17 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.086 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 408' ' ' PRO . . . . . 0.648 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 74.1 Cg_endo -77.1 125.52 7.98 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 122.551 2.167 . . . . 0.0 112.267 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -130.33 152.75 49.4 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.55 178.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -77.1 110.68 11.96 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.085 0.469 . . . . 0.0 110.376 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -93.85 -135.52 0.18 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.074 -178.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.497 ' H ' ' HG ' ' A' ' 412' ' ' LEU . 0.1 OUTLIER -81.22 129.26 67.52 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 179.508 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -78.83 164.98 24.97 Favored 'Trans proline' 0 C--O 1.237 0.47 0 C-N-CA 122.654 2.236 . . . . 0.0 112.586 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.509 ' HB ' ' HB3' ' A' ' 93' ' ' SER . 4.1 t -75.55 164.7 26.07 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.972 179.311 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.635 177.092 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.1 0 CA-C-O 120.955 0.407 . . . . 0.0 110.163 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.707 HD21 ' HB ' ' A' ' 414' ' ' THR . 0.3 OUTLIER -162.58 158.23 23.11 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.096 -179.414 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -62.59 -63.77 1.12 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.082 178.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -96.85 9.46 65.99 Favored Glycine 0 C--O 1.229 -0.19 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.402 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.54 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 5.2 t-20 61.01 94.49 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.482 0.658 . . . . 0.0 111.958 -178.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.436 ' HB2' HG22 ' A' ' 414' ' ' THR . 0.7 OUTLIER -146.82 -146.15 0.19 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 177.498 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.54 108.78 2.67 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.457 -0.878 . . . . 0.0 111.97 176.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.655 ' HB2' HD12 ' A' ' 80' ' ' LEU . . . -110.52 150.57 28.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.815 0.341 . . . . 0.0 111.381 -176.474 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -73.39 128.57 35.87 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 175.286 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.59 -5.39 47.54 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.638 -172.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.489 ' CB ' ' HB3' ' A' ' 112' ' ' CYS . . . -84.64 -46.93 11.02 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 121.039 -0.264 . . . . 0.0 110.738 -177.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.544 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 31.2 p -110.18 -74.65 0.64 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.192 -178.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.544 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 134.81 7.07 2.14 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 111.476 -0.649 . . . . 0.0 111.476 -176.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -73.88 131.45 41.5 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.059 0.457 . . . . 0.0 110.436 178.137 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.494 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 1.4 m -69.03 121.18 16.13 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.839 175.242 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.6 mp -74.89 113.52 25.51 Favored Pre-proline 0 C--N 1.326 -0.427 0 O-C-N 123.62 0.575 . . . . 0.0 112.287 -172.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.494 ' HD3' ' O ' ' A' ' 93' ' ' SER . 5.6 Cg_exo -80.56 167.49 18.93 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 123.407 2.738 . . . . 0.0 110.879 167.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.68 -1.47 24.93 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.056 0.455 . . . . 0.0 111.063 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.62 -29.09 22.82 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.071 178.258 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -85.97 173.89 9.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.502 -178.19 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.485 ' HB2' HD22 ' A' ' 110' ' ' LEU . 25.5 mt -125.73 128.77 48.28 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.592 -178.389 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.08 147.74 30.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.99 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 1.9 mtt -105.14 155.55 18.91 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.44 177.064 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 93.0 mtm-85 -112.6 98.69 7.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.677 0.275 . . . . 0.0 110.331 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -79.95 -36.36 36.31 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.121 0.486 . . . . 0.0 110.42 178.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.484 ' HB2' ' H ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -152.63 -127.45 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.675 178.69 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.484 ' H ' ' HB2' ' A' ' 104' ' ' GLN . . . -78.08 -26.31 60.28 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.741 -0.742 . . . . 0.0 111.853 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -103.27 162.31 13.1 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.937 0.399 . . . . 0.0 110.297 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 2.4 m -103.39 160.56 4.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.423 -176.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -137.29 143.1 41.98 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.634 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 7.6 m80 -69.27 161.87 28.36 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.871 0.367 . . . . 0.0 111.581 -177.383 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.485 HD22 ' HB2' ' A' ' 99' ' ' LEU . 0.3 OUTLIER -67.34 -27.63 67.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.231 0.538 . . . . 0.0 109.99 173.226 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.6 -23.19 22.01 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.738 178.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.634 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 63.6 m -94.77 -18.71 21.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.379 -176.244 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' PHE . . . . . 0.465 ' HD1' ' HA ' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -67.5 82.75 0.16 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.578 0.704 . . . . 0.0 110.508 177.029 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.604 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.5 p -135.47 160.99 36.73 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.693 -178.015 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.436 ' SG ' ' N ' ' A' ' 119' ' ' ARG . 26.2 p -72.73 149.94 43.3 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.349 0.595 . . . . 0.0 111.078 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.77 -2.27 58.51 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.455 179.232 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.575 ' HB ' ' SG ' ' A' ' 118' ' ' CYS . 0.8 OUTLIER -90.41 -54.68 3.9 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.65 -177.884 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.682 ' SG ' ' HB2' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -123.75 -20.9 5.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.231 -172.481 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.439 ' HB2' ' O ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER 81.02 50.97 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 123.812 0.845 . . . . 0.0 111.288 -179.289 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -97.32 151.65 19.69 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 169.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.604 ' HA ' HG22 ' A' ' 114' ' ' THR . 1.1 ttm180 -86.15 130.14 34.62 Favored 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.005 -176.297 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.419 HD13 ' HB2' ' A' ' 128' ' ' PHE . 16.0 mt -77.25 158.42 30.27 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 173.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -134.39 139.12 31.83 Favored Pre-proline 0 C--N 1.325 -0.476 0 C-N-CA 119.967 -0.693 . . . . 0.0 111.35 -169.046 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.437 ' HB3' ' HD3' ' A' ' 408' ' ' PRO . 11.7 Cg_endo -55.68 121.63 10.3 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 123.075 2.516 . . . . 0.0 111.874 177.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 91.0 -2.06 78.81 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.438 -0.887 . . . . 0.0 112.331 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -112.26 -179.2 3.61 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 177.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.511 ' HG2' HD13 ' A' ' 404' ' ' ILE . 1.3 mtt85 -88.78 149.14 23.57 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.417 0.627 . . . . 0.0 112.314 -171.289 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.419 ' HB2' HD13 ' A' ' 122' ' ' LEU . 0.6 OUTLIER -148.91 145.58 27.48 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 175.721 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 129' ' ' HIS . . . . . 0.57 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 60.8 m-70 -115.31 121.65 43.52 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.76 0.314 . . . . 0.0 110.915 -175.097 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.501 ' HA ' ' O ' ' A' ' 134' ' ' SER . 1.4 t80 -112.58 100.78 8.99 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 174.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.489 ' HB ' ' CE2' ' A' ' 136' ' ' PHE . 8.4 mt -124.04 124.01 67.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.198 -175.802 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 61.1 33.96 19.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.237 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 69.39 35.1 75.4 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.869 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.501 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.8 OUTLIER -131.67 154.24 49.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.798 0.299 . . . . 0.0 110.359 -178.046 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 13.2 mt -96.54 114.59 26.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.497 -177.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.57 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 30.9 m-85 -120.43 157.26 29.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.343 0.592 . . . . 0.0 110.414 179.068 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' CYS . . . . . 0.562 ' HB2' ' H ' ' A' ' 140' ' ' ASP . 0.5 OUTLIER -92.55 152.41 19.64 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.921 -175.233 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.428 ' OE1' ' HD2' ' A' ' 127' ' ' ARG . 16.8 tp10 -80.37 -24.83 39.5 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.731 0.776 . . . . 0.0 108.909 161.377 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -81.54 -52.55 7.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.931 -171.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.682 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -114.94 34.39 4.86 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -178.322 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ARG . . . . . 0.481 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 9.9 ttp-105 -48.4 129.38 13.23 Favored Pre-proline 0 N--CA 1.464 0.27 0 CA-C-N 114.323 -1.308 . . . . 0.0 112.511 -173.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 142' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 21.2 Cg_exo -66.03 141.4 63.92 Favored 'Trans proline' 0 C--O 1.235 0.358 0 C-N-CA 122.829 2.353 . . . . 0.0 112.086 178.238 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.11 -3.9 57.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.558 -179.204 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -97.55 -74.14 0.58 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.808 -176.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.496 ' H ' ' HG ' ' A' ' 145' ' ' LEU . 0.0 OUTLIER -84.12 85.77 7.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.922 0.392 . . . . 0.0 111.08 -176.159 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.326 -0.433 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.991 176.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.684 0 N-CA-C 112.183 -0.367 . . . . 0.0 112.183 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.43 -176.15 2.91 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.137 0.494 . . . . 0.0 111.316 -176.185 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 404' ' ' ILE . . . . . 0.511 HD13 ' HG2' ' A' ' 127' ' ' ARG . 10.7 mm -111.38 135.54 50.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 176.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -59.5 113.21 6.53 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 177.146 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 406' ' ' PRO . . . . . 0.466 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 83.7 Cg_exo -45.64 -72.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.655 2.904 . . . . 0.0 112.819 -172.288 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 407' ' ' PHE . . . . . 0.466 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 1.1 t80 168.95 139.28 0.05 OUTLIER Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.147 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 408' ' ' PRO . . . . . 0.437 ' HD3' ' HB3' ' A' ' 124' ' ' PRO . 73.1 Cg_endo -85.87 107.13 0.9 Allowed 'Trans proline' 0 N--CA 1.446 -1.323 0 C-N-CA 122.22 1.947 . . . . 0.0 110.907 171.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -129.81 168.98 15.74 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.428 -175.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -77.22 111.12 12.51 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.203 177.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -89.2 -168.63 2.23 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.966 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.428 ' H ' ' HG ' ' A' ' 412' ' ' LEU . 0.1 OUTLIER -64.68 121.17 71.71 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.27 179.408 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -57.26 127.48 25.77 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.773 2.315 . . . . 0.0 111.815 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.707 ' HB ' HD21 ' A' ' 80' ' ' LEU . 34.0 p -85.3 161.13 19.65 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.567 -175.833 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 CA--C 1.532 0.271 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.038 -179.392 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 48.1 ttt85 . . . . . 0 CA--C 1.521 -0.164 0 CA-C-O 121.141 0.496 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.685 ' HB3' ' HA ' ' A' ' 83' ' ' ASN . 6.5 mp -83.97 10.76 9.07 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.586 -175.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.406 ' C ' ' H ' ' A' ' 83' ' ' ASN . 0.3 OUTLIER 49.28 84.48 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.558 0 O-C-N 123.803 0.69 . . . . 0.0 111.805 177.039 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.08 -16.98 19.35 Favored Glycine 0 C--O 1.228 -0.253 0 C-N-CA 120.306 -0.95 . . . . 0.0 111.083 -174.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.685 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 1.8 t30 71.11 54.39 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 123.654 0.781 . . . . 0.0 111.3 175.146 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.68 -58.44 1.88 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.565 177.215 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -155.38 142.82 9.23 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.615 -0.803 . . . . 0.0 112.382 -178.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.519 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . . . -154.24 171.11 19.74 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.517 ' HB2' ' HA ' ' A' ' 108' ' ' TYR . 0.1 OUTLIER -95.76 145.04 25.63 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.1 m -82.01 6.37 16.35 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -174.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.642 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -96.98 -59.59 1.76 Allowed 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.86 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.446 ' SG ' ' HB2' ' A' ' 92' ' ' GLN . 19.8 p -92.72 -36.76 12.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.85 0.357 . . . . 0.0 110.108 178.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 98.04 -3.37 60.29 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.487 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.446 ' HB2' ' SG ' ' A' ' 90' ' ' CYS . 0.0 OUTLIER -81.18 159.14 24.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.937 0.398 . . . . 0.0 110.612 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.24 164.82 17.45 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.651 -173.794 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.5 mt -113.83 99.83 50.97 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.807 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -77.04 159.68 33.79 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.589 2.193 . . . . 0.0 111.243 174.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -70.07 -10.07 57.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.132 0.491 . . . . 0.0 111.125 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.51 -13.32 52.21 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.002 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -117.25 147.78 42.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.977 -178.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.633 ' HB2' ' HB2' ' A' ' 408' ' ' PRO . 1.0 OUTLIER -108.43 141.6 40.05 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.857 -179.657 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -115.59 139.66 40.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.139 0.495 . . . . 0.0 111.125 -177.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.19 122.1 28.89 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.659 177.312 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.482 HH21 ' CD ' ' A' ' 409' ' ' GLU . 0.0 OUTLIER -113.75 142.16 46.39 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.219 -178.649 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -118.48 -76.54 0.57 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.531 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.508 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 0.2 OUTLIER -90.64 -93.64 0.13 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.145 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.508 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -120.16 0.16 13.01 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.4 175.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -103.07 163.67 12.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.746 0.307 . . . . 0.0 110.821 -177.468 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.2 m -134.91 148.12 29.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.329 -178.306 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' TYR . . . . . 0.517 ' HA ' ' HB2' ' A' ' 87' ' ' CYS . 6.1 m-85 -138.67 146.59 41.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.68 177.08 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.933 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 54.2 m80 -72.33 168.74 17.73 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.442 HD21 ' HG3' ' A' ' 408' ' ' PRO . 0.3 OUTLIER -63.02 -31.85 73.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.207 0.527 . . . . 0.0 110.939 178.887 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.475 ' HG3' ' SG ' ' A' ' 112' ' ' CYS . 3.4 pttp -89.35 0.65 56.66 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.05 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.933 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 4.6 m -117.41 -10.1 10.76 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.557 -176.276 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.6 69.68 2.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.549 0.69 . . . . 0.0 110.251 176.517 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.749 HG22 ' HA ' ' A' ' 121' ' ' ARG . 19.7 p -138.71 153.45 48.51 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.152 -0.931 . . . . 0.0 109.425 -178.284 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.488 ' HB3' ' HA ' ' A' ' 136' ' ' PHE . 3.6 p -71.89 153.2 42.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.059 0.457 . . . . 0.0 110.673 179.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -84.15 -8.02 59.2 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.063 0.459 . . . . 0.0 110.727 178.036 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.16 -51.11 5.76 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.925 -178.229 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.61 -6.45 10.19 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.487 -177.791 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.453 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 61.78 35.86 16.51 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.063 0.459 . . . . 0.0 110.551 -179.272 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -80.95 131.61 35.34 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.643 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.749 ' HA ' HG22 ' A' ' 114' ' ' THR . 1.1 tpp85 -72.65 115.42 11.9 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.97 -178.178 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.475 HD13 ' HD2' ' A' ' 128' ' ' PHE . 5.6 mt -74.97 139.62 43.09 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 177.604 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -131.28 133.23 24.29 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-O 120.704 0.287 . . . . 0.0 111.603 -169.442 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -60.9 113.23 1.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.481 2.12 . . . . 0.0 110.538 171.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 120.21 -22.59 8.4 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 110.748 -0.941 . . . . 0.0 110.748 -173.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.01 -175.46 2.69 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.445 ' HB3' ' HG2' ' A' ' 138' ' ' GLU . 8.7 ttm-85 -99.07 148.37 24.11 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.849 0.357 . . . . 0.0 111.159 -173.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.475 ' HD2' HD13 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -143.2 156.76 44.83 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.508 176.366 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 129' ' ' HIS . . . . . 0.6 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 4.6 m-70 -117.39 117.89 30.72 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.001 0.429 . . . . 0.0 110.517 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.457 ' HA ' ' O ' ' A' ' 134' ' ' SER . 16.3 t80 -118.75 101.67 8.26 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 176.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -124.62 113.75 37.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.574 -177.598 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 7.0 t30 56.67 41.07 28.87 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.226 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 75.04 33.48 54.65 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.748 -0.739 . . . . 0.0 113.019 177.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.457 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.6 OUTLIER -126.98 145.45 50.7 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.828 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 79.1 mt -101.35 124.46 47.07 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.339 0.399 . . . . 0.0 110.967 -176.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.6 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 76.4 m-85 -135.95 164.4 28.06 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.613 175.269 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' CYS . . . . . 0.578 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 30.9 p -113.55 -167.23 1.17 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.28 0.562 . . . . 0.0 111.844 -175.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.445 ' HG2' ' HB3' ' A' ' 127' ' ' ARG . 1.3 mt-10 -75.36 -30.08 60.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.261 176.147 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' HIS . . . . . 0.481 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 77.6 t60 -73.84 -30.87 62.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.113 177.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.578 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.9 OUTLIER -66.47 -80.89 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.095 175.182 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 48.97 59.65 16.78 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.362 -177.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' PRO . . . . . 0.551 ' HD3' ' HB3' ' A' ' 140' ' ' ASP . 37.6 Cg_endo -66.01 92.37 0.26 Allowed 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.849 2.366 . . . . 0.0 112.03 -175.586 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' THR . . . . . 0.442 ' HA ' HG12 ' A' ' 146' ' ' ILE . 0.2 OUTLIER -76.23 58.86 1.31 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.371 -178.529 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -125.68 -65.88 0.97 Allowed 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.469 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -115.73 43.06 2.17 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.076 0.465 . . . . 0.0 110.266 179.059 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.442 HG12 ' HA ' ' A' ' 143' ' ' THR . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.833 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.528 0 N-CA-C 111.634 -0.586 . . . . 0.0 111.634 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.62 167.42 11.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.92 0.39 . . . . 0.0 110.686 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 46.9 mm -76.19 130.14 36.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -56.67 130.77 77.71 Favored Pre-proline 0 C--N 1.33 -0.247 0 O-C-N 123.337 0.398 . . . . 0.0 111.346 -177.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 406' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.78 162.07 30.01 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.851 2.368 . . . . 0.0 112.169 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -88.45 152.69 50.05 Favored Pre-proline 0 C--N 1.319 -0.758 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.043 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 408' ' ' PRO . . . . . 0.633 ' HB2' ' HB2' ' A' ' 99' ' ' LEU . 51.2 Cg_endo -70.27 126.62 13.17 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 122.161 1.907 . . . . 0.0 111.758 176.268 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 409' ' ' GLU . . . . . 0.482 ' CD ' HH21 ' A' ' 102' ' ' ARG . 2.6 mt-10 -127.0 160.7 30.32 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.465 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -79.5 123.52 27.64 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.651 -0.499 . . . . 0.0 109.651 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -103.38 -106.3 0.28 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.22 -177.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.78 117.23 37.8 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.42 131.94 26.07 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.578 2.186 . . . . 0.0 112.773 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 19.2 m -56.36 142.0 39.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.045 -0.98 . . . . 0.0 111.084 174.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 11.1 m . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.107 -176.016 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.8 mtp85 . . . . . 0 N--CA 1.461 0.122 0 CA-C-O 121.279 0.562 . . . . 0.0 109.954 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.612 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 1.4 pt? -121.01 -179.43 4.02 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.494 -169.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -105.81 141.81 36.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.224 175.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.64 -40.95 2.99 Favored Glycine 0 CA--C 1.517 0.2 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.616 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.598 ' HA ' HD21 ' A' ' 80' ' ' LEU . 2.3 t-20 81.75 33.76 0.1 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.637 0.775 . . . . 0.0 112.198 175.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.449 ' N ' HD11 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -130.25 66.99 1.48 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.282 177.032 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 117.65 98.18 1.95 Allowed Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.459 -0.877 . . . . 0.0 113.093 175.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.612 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -138.33 156.47 47.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.144 0.497 . . . . 0.0 110.838 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 4.6 t -70.4 146.57 50.31 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.392 178.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.94 8.54 39.36 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.525 172.346 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.453 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -120.94 -59.62 1.72 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.453 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.487 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 30.3 p -93.09 -77.61 0.44 Allowed 'General case' 0 C--O 1.233 0.207 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.541 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.487 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 145.84 -3.03 1.08 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.642 -0.789 . . . . 0.0 113.142 176.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.9 tp60 -63.89 128.39 35.59 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 117.275 0.538 . . . . 0.0 110.616 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.857 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.7 OUTLIER -56.34 120.79 8.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.804 -0.634 . . . . 0.0 109.54 172.389 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.401 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 5.1 mt -75.89 113.39 26.83 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 112.224 0.454 . . . . 0.0 112.224 -172.365 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.677 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 5.7 Cg_exo -78.19 167.68 22.9 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.373 2.715 . . . . 0.0 111.083 172.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.19 -2.87 26.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.86 0.362 . . . . 0.0 111.16 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.93 8.38 34.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.954 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.677 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 1.6 mm-40 -119.03 134.54 55.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.885 177.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.543 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 1.4 mt -100.82 136.63 40.37 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.061 0.458 . . . . 0.0 110.342 -178.352 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 1.6 m -115.37 136.5 51.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.718 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.461 ' SD ' ' HG3' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -84.26 123.42 30.12 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.068 -179.446 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 13.2 ptt85 -90.24 121.46 32.28 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.103 -177.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -105.13 -27.35 11.65 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.922 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -179.41 -128.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.811 -178.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -78.33 -8.29 87.57 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.567 -0.825 . . . . 0.0 111.252 173.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 28.5 m-20 -102.93 142.05 34.7 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 177.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -126.49 141.54 45.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.005 0.431 . . . . 0.0 110.896 -177.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -129.29 172.77 11.15 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 177.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.795 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 13.9 m80 -85.17 170.73 12.59 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 177.069 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.416 ' HA ' ' SD ' ' A' ' 101' ' ' MET . 0.3 OUTLIER -69.63 -23.54 63.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.32 0.581 . . . . 0.0 109.521 173.578 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.485 ' HG2' ' HB3' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -90.25 -18.75 25.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.409 176.469 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.795 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 55.6 m -100.78 7.39 43.81 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.241 0.543 . . . . 0.0 111.06 -176.004 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' PHE . . . . . 0.453 ' HD1' ' HA ' ' A' ' 113' ' ' PHE . 0.1 OUTLIER -89.69 73.06 7.68 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.3 0.571 . . . . 0.0 110.273 177.84 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.628 HG22 ' HA ' ' A' ' 121' ' ' ARG . 15.2 p -133.48 155.7 49.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.145 -179.663 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 26.8 p -73.21 153.49 40.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.048 0.451 . . . . 0.0 110.816 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.49 2.16 42.3 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.977 -176.016 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -109.05 -51.63 2.86 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -179.005 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.95 -10.5 13.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.899 0.381 . . . . 0.0 110.941 -177.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 58.84 35.53 24.28 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.201 -177.006 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -73.87 120.8 19.96 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 174.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.628 ' HA ' HG22 ' A' ' 114' ' ' THR . 3.6 ttm180 -66.83 124.91 24.25 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.986 0.422 . . . . 0.0 110.749 -178.676 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.744 HD22 ' HB2' ' A' ' 128' ' ' PHE . 1.7 mt -76.75 158.91 30.58 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.138 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.547 ' O ' ' HB3' ' A' ' 405' ' ' ALA . 71.9 t -126.51 132.12 24.19 Favored Pre-proline 0 C--N 1.327 -0.41 0 C-N-CA 121.096 -0.241 . . . . 0.0 110.415 -172.423 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.06 111.39 0.89 Allowed 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.705 2.27 . . . . 0.0 111.096 175.494 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 93.49 17.09 43.53 Favored Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 120.568 -0.825 . . . . 0.0 111.793 -177.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -133.8 -176.17 4.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.815 0.34 . . . . 0.0 111.031 176.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -75.35 127.12 32.43 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.439 -172.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.744 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -145.62 165.72 27.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 172.593 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 129' ' ' HIS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 136' ' ' PHE . 0.6 OUTLIER -131.19 128.67 40.46 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.719 -0.613 . . . . 0.0 111.822 -178.194 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.462 ' HB2' ' CZ ' ' A' ' 128' ' ' PHE . 1.7 t80 -125.58 101.07 6.73 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.063 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 56.2 mt -110.22 103.81 16.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.192 -177.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.7 t30 53.64 38.91 29.38 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.686 0.617 . . . . 0.0 111.262 -178.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.406 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 85.63 21.46 53.64 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.65 -0.786 . . . . 0.0 113.297 177.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -113.76 134.06 54.99 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 117.201 0.501 . . . . 0.0 109.769 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.416 ' HA ' HD23 ' A' ' 135' ' ' LEU . 14.5 mt -88.64 115.25 26.03 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.937 0.399 . . . . 0.0 111.23 -176.317 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.55 ' HB2' ' HB3' ' A' ' 129' ' ' HIS . 63.9 m-85 -131.09 168.18 17.85 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.554 176.437 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' CYS . . . . . 0.654 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 24.9 p -113.78 -169.65 1.55 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.204 0.525 . . . . 0.0 110.854 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.65 -28.97 51.43 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.99 177.781 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -77.83 -28.28 50.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.493 0.663 . . . . 0.0 109.517 178.536 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.654 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.4 OUTLIER -67.18 -82.15 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.313 174.657 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 42.46 73.33 0.94 Allowed Pre-proline 0 C--O 1.237 0.438 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.964 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' PRO . . . . . 0.554 ' O ' ' HB ' ' A' ' 146' ' ' ILE . 50.4 Cg_exo -55.41 100.91 0.08 OUTLIER 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.758 2.305 . . . . 0.0 111.711 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.61 56.49 3.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.825 -173.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -158.72 -78.1 0.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.558 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.505 ' HA ' HD22 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -89.01 71.73 8.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.436 0.636 . . . . 0.0 109.562 175.576 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.554 ' HB ' ' O ' ' A' ' 142' ' ' PRO . 11.5 tt . . . . . 0 C--N 1.321 -0.662 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.234 -176.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.936 0 N-CA-C 112.183 -0.367 . . . . 0.0 112.183 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -113.61 134.19 54.86 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.917 0.389 . . . . 0.0 110.2 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 38.5 mm -79.27 117.99 25.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 176.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 405' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 123' ' ' VAL . . . -59.94 132.79 89.61 Favored Pre-proline 0 C--O 1.235 0.34 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.321 -175.059 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 406' ' ' PRO . . . . . 0.521 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 2.8 Cg_exo -76.65 -170.81 0.96 Allowed 'Trans proline' 0 N--CA 1.462 -0.364 0 C-N-CA 123.663 2.909 . . . . 0.0 112.414 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -104.73 158.36 32.16 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.269 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 408' ' ' PRO . . . . . 0.543 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 5.8 Cg_exo -77.62 141.4 19.65 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.778 2.318 . . . . 0.0 112.086 178.13 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.32 177.28 7.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.291 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -104.28 121.1 42.63 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 178.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -84.8 -102.94 0.05 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.219 -178.255 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -131.74 130.89 22.44 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -68.01 145.33 67.27 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.132 1.888 . . . . 0.0 111.658 176.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.857 HG21 ' HB3' ' A' ' 93' ' ' SER . 0.1 OUTLIER -76.19 178.1 6.68 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.055 -176.196 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.301 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.099 178.06 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.637 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.117 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.717 HD21 ' HB ' ' A' ' 414' ' ' THR . 0.5 OUTLIER -144.76 -179.97 6.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.948 0.404 . . . . 0.0 111.281 -177.847 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -92.15 -60.56 1.82 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.219 177.696 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.536 ' HA3' ' HA ' ' A' ' 415' ' ' SER . . . -87.19 -1.89 83.82 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.185 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 60.92 93.42 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.342 0.591 . . . . 0.0 111.923 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.47 ' HB2' HG22 ' A' ' 414' ' ' THR . 0.6 OUTLIER -146.31 -76.78 0.19 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.475 178.733 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -148.1 127.05 2.48 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 110.519 -1.033 . . . . 0.0 110.519 177.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -118.69 164.47 15.31 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.851 0.358 . . . . 0.0 111.296 -175.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 27.9 t -63.79 144.3 57.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.237 177.111 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.54 -8.16 58.47 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.297 -178.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.431 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -111.37 -33.69 6.34 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.08 -0.248 . . . . 0.0 111.148 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.464 ' SG ' ' NZ ' ' A' ' 111' ' ' LYS . 32.0 m -100.03 -79.2 0.5 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.552 0.691 . . . . 0.0 110.272 175.851 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.637 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 113.28 57.56 0.41 Allowed Glycine 0 N--CA 1.442 -0.958 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.767 -176.267 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -146.65 178.39 8.33 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 177.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.611 ' HA ' HD11 ' A' ' 80' ' ' LEU . 0.1 OUTLIER -76.29 160.48 29.59 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.383 0.611 . . . . 0.0 111.326 -177.524 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.658 HG12 HG11 ' A' ' 100' ' ' VAL . 2.8 mp -118.65 100.3 51.17 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.542 177.353 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.626 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 6.4 Cg_exo -75.41 167.78 25.93 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 123.238 2.626 . . . . 0.0 112.029 176.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.84 -16.01 60.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.88 -177.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.07 -17.24 29.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.955 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.626 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 12.6 mp0 -100.42 147.82 25.43 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.338 -177.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.403 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 21.9 mt -103.97 141.72 35.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.031 0.443 . . . . 0.0 111.088 -176.217 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.658 HG11 HG12 ' A' ' 94' ' ' ILE . 0.9 OUTLIER -125.94 147.24 30.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.037 178.121 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.461 ' SD ' ' HA ' ' A' ' 110' ' ' LEU . 0.0 OUTLIER -97.94 112.59 24.46 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.007 0.432 . . . . 0.0 110.308 -179.215 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -82.51 113.12 20.03 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.472 -179.092 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -100.11 -45.51 5.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.675 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.451 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 4.9 mm-40 -154.76 -137.84 0.07 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.102 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.451 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -75.47 -9.59 84.54 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 120.951 -0.643 . . . . 0.0 112.293 179.286 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -105.24 160.58 14.98 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 176.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -118.66 139.4 46.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.209 0.528 . . . . 0.0 111.921 -174.231 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -131.48 168.32 17.84 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 174.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.822 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 73.9 m80 -94.53 -163.92 1.11 Allowed 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.461 ' HA ' ' SD ' ' A' ' 101' ' ' MET . 0.4 OUTLIER -84.03 -20.22 33.09 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.002 0.429 . . . . 0.0 110.977 177.153 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.465 ' HG3' ' SG ' ' A' ' 112' ' ' CYS . 0.0 OUTLIER -89.79 -22.09 22.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.74 -175.263 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.822 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -94.45 -5.46 46.18 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.156 -173.548 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.63 74.54 4.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.358 0.599 . . . . 0.0 109.616 175.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.606 HG22 ' HG2' ' A' ' 121' ' ' ARG . 38.2 p -127.39 147.8 50.27 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.171 -179.161 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.57 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 7.6 p -71.38 146.58 48.66 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.17 0.509 . . . . 0.0 110.355 177.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.08 -1.79 57.25 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.378 -176.086 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.35 -51.25 3.69 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -175.811 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.624 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -119.52 -3.71 10.39 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 111.645 0.239 . . . . 0.0 111.645 -175.999 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 70.61 38.98 1.2 Allowed 'General case' 0 C--O 1.233 0.221 0 O-C-N 123.847 0.717 . . . . 0.0 110.6 179.689 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -78.91 128.29 33.11 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.917 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.606 ' HG2' HG22 ' A' ' 114' ' ' THR . 0.2 OUTLIER -78.64 109.08 12.52 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 178.468 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.523 HD22 ' HB2' ' A' ' 128' ' ' PHE . 6.4 mt -67.73 148.59 51.08 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.914 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -136.8 140.28 31.37 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.214 -170.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.718 ' HB3' ' HA ' ' A' ' 407' ' ' PHE . 13.5 Cg_endo -55.77 111.42 0.76 Allowed 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.943 2.428 . . . . 0.0 111.887 178.217 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 108.06 -15.47 36.65 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.311 -176.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -97.55 -179.24 4.4 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.814 ' HD3' ' HG3' ' A' ' 138' ' ' GLU . 0.1 OUTLIER -101.77 143.11 32.1 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.055 0.455 . . . . 0.0 111.462 -171.932 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.523 ' HB2' HD22 ' A' ' 122' ' ' LEU . 1.4 p90 -149.72 151.46 33.69 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.748 176.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' HIS . . . . . 0.637 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 59.9 m-70 -113.29 118.51 34.83 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.033 0.444 . . . . 0.0 110.88 -177.511 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' A' ' 134' ' ' SER . 23.5 t80 -108.36 101.35 10.55 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.879 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.473 HG21 ' O ' ' A' ' 145' ' ' LEU . 2.6 mt -130.64 132.41 64.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.771 179.242 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 55.7 t30 55.38 35.76 25.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.407 0.622 . . . . 0.0 110.449 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.407 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 67.36 35.93 88.33 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.809 178.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.482 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 4.3 m -131.27 151.18 51.74 Favored 'General case' 0 CA--C 1.517 -0.318 0 O-C-N 122.677 -0.308 . . . . 0.0 110.294 -177.529 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.7 mt -101.94 121.32 41.91 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.714 -177.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.637 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 59.7 m-85 -126.51 172.27 10.36 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 175.605 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 8.9 p -125.24 177.49 6.1 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.727 0.298 . . . . 0.0 110.774 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.814 ' HG3' ' HD3' ' A' ' 127' ' ' ARG . 8.8 mm-40 -77.92 -13.52 59.86 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.013 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -78.14 -33.45 50.38 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.624 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 2.7 p30 -91.92 -48.08 6.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.279 176.018 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ARG . . . . . 0.452 HH11 ' HD2' ' A' ' 141' ' ' ARG . 0.0 OUTLIER 43.64 88.23 0.1 Allowed Pre-proline 0 N--CA 1.466 0.331 0 C-N-CA 124.118 0.967 . . . . 0.0 112.993 175.313 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -72.25 72.8 2.77 Favored 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 122.971 2.447 . . . . 0.0 112.041 178.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.41 55.81 0.82 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.469 0.652 . . . . 0.0 111.789 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -147.87 -56.75 0.23 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 175.605 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.473 ' O ' HG21 ' A' ' 131' ' ' ILE . 0.2 OUTLIER -90.34 71.87 7.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.78 174.721 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.324 -0.5 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.346 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.555 0 N-CA-C 111.882 -0.487 . . . . 0.0 111.882 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.48 155.91 20.34 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 47.7 mm -110.0 134.97 50.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.466 -178.072 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -68.98 121.81 82.93 Favored Pre-proline 0 C--N 1.328 -0.348 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 175.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 406' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -57.54 -90.99 0.0 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.125 2.55 . . . . 0.0 112.905 -175.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 407' ' ' PHE . . . . . 0.718 ' HA ' ' HB3' ' A' ' 124' ' ' PRO . 0.2 OUTLIER -171.78 150.9 2.68 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -178.833 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 408' ' ' PRO . . . . . 0.605 ' HD2' ' CD1' ' A' ' 407' ' ' PHE . 47.8 Cg_endo -72.7 111.25 3.2 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 121.761 1.64 . . . . 0.0 110.723 168.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -120.38 170.36 9.44 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.358 -173.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -92.1 109.96 21.32 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 176.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -84.11 -94.09 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.216 -176.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.408 ' HA ' ' HD2' ' A' ' 413' ' ' PRO . 0.3 OUTLIER -131.24 126.32 21.37 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.895 -177.175 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 413' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 412' ' ' LEU . 21.8 Cg_endo -62.99 125.03 15.04 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.613 2.209 . . . . 0.0 111.292 173.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.717 ' HB ' HD21 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -107.42 162.35 14.0 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.039 -176.06 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 415' ' ' SER . . . . . 0.536 ' HA ' ' HA3' ' A' ' 82' ' ' GLY . 14.1 m . . . . . 0 C--O 1.235 0.291 0 O-C-N 123.568 0.542 . . . . 0.0 110.686 -178.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.516 -0.344 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.681 HD12 ' HA ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -96.16 112.98 24.55 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.213 -173.094 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -61.05 -38.75 87.28 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.705 0.764 . . . . 0.0 109.179 175.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -100.83 111.79 4.24 Favored Glycine 0 N--CA 1.441 -0.974 0 N-CA-C 109.855 -1.298 . . . . 0.0 109.855 168.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.681 ' HA ' HD12 ' A' ' 80' ' ' LEU . 0.8 OUTLIER -71.68 12.72 0.33 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -170.051 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.602 ' HB2' ' HB3' ' A' ' 412' ' ' LEU . 0.1 OUTLIER -82.0 -37.12 27.07 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.604 0.24 . . . . 0.0 110.869 178.269 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 176.67 170.11 38.82 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.927 -0.654 . . . . 0.0 111.859 -177.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.508 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -162.45 171.36 17.23 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.946 0.373 . . . . 0.0 110.814 -178.429 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.526 ' HB2' ' CE1' ' A' ' 109' ' ' HIS . 42.1 t -73.16 145.86 46.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.911 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.13 -6.96 59.49 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.997 0.427 . . . . 0.0 110.505 175.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -113.04 -49.89 2.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.067 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 26.9 m -84.4 -28.08 27.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.049 0.452 . . . . 0.0 110.604 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.97 25.9 75.01 Favored Glycine 0 N--CA 1.451 -0.341 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.947 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -115.38 142.08 47.17 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.491 -0.188 . . . . 0.0 110.491 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.7 m -65.55 157.74 28.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.143 176.652 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.72 ' O ' ' HA ' ' A' ' 413' ' ' PRO . 3.4 mp -113.12 116.69 46.74 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.477 -172.076 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.455 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 6.2 Cg_exo -75.52 165.95 29.52 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.925 2.417 . . . . 0.0 111.192 171.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.72 -16.65 61.66 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.34 0.59 . . . . 0.0 110.505 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.18 -14.77 59.32 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.093 177.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.455 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -109.64 159.57 17.01 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.184 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.3 mt -120.97 146.8 46.29 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.511 0.672 . . . . 0.0 110.931 -176.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.746 HG21 ' HB2' ' A' ' 411' ' ' ALA . 13.9 m -119.76 179.28 2.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.96 -178.183 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.1 mmt -134.09 122.38 22.84 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 174.113 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.4 105.38 12.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.049 0.452 . . . . 0.0 110.973 -175.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.402 ' HB2' ' HE1' ' A' ' 113' ' ' PHE . . . -88.25 66.75 8.55 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.866 179.42 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 55.7 47.36 20.69 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.368 178.117 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 130.74 -59.63 0.69 Allowed Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.407 178.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -89.99 170.31 10.47 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.886 -0.185 . . . . 0.0 110.553 -178.01 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -127.33 134.01 66.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.515 0.674 . . . . 0.0 112.42 -174.558 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -116.79 179.13 4.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 169.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.878 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 72.8 m80 -94.99 -164.29 1.15 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 176.02 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.6 tp -79.16 -23.03 44.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.949 0.404 . . . . 0.0 110.9 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.437 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.35 -38.29 13.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.253 0.549 . . . . 0.0 111.35 -176.759 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.878 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.26 -17.66 59.37 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.388 -175.472 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 113' ' ' PHE . . . . . 0.402 ' HE1' ' HB2' ' A' ' 103' ' ' ALA . 0.1 OUTLIER -72.16 77.02 0.96 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.592 0.711 . . . . 0.0 110.327 176.883 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.752 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.9 OUTLIER -145.6 164.05 32.9 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.083 -177.224 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.501 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 19.9 p -77.97 152.56 33.08 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 120.25 -0.58 . . . . 0.0 109.858 176.036 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.9 5.61 50.72 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.236 0.541 . . . . 0.0 110.722 -179.127 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.1 -50.77 3.55 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.804 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.94 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -113.53 -13.06 12.82 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.701 0.286 . . . . 0.0 111.064 178.183 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.501 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 65.45 39.36 5.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.38 -177.602 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 57.2 t30 -86.44 133.16 33.79 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 176.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.752 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.0 OUTLIER -70.32 109.77 4.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.33 -179.01 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.566 HD13 ' HB2' ' A' ' 128' ' ' PHE . 19.8 mt -63.9 149.95 46.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.415 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.55 ' HB ' ' CB ' ' A' ' 126' ' ' ASP . 21.6 t -110.23 130.75 22.52 Favored Pre-proline 0 C--N 1.321 -0.636 0 C-N-CA 120.314 -0.554 . . . . 0.0 110.962 -167.701 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.48 ' HB3' ' HA ' ' A' ' 407' ' ' PHE . 17.9 Cg_endo -58.93 111.5 0.91 Allowed 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.843 2.362 . . . . 0.0 111.046 174.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 92.6 13.75 56.44 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.23 -177.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.55 ' CB ' ' HB ' ' A' ' 123' ' ' VAL . 1.4 t70 -133.09 -172.93 3.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.599 0.238 . . . . 0.0 110.755 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.21 136.55 57.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.059 -0.518 . . . . 0.0 112.31 -174.656 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.566 ' HB2' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -157.13 144.97 19.1 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.359 -0.837 . . . . 0.0 108.852 172.85 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 129' ' ' HIS . . . . . 0.546 ' O ' ' HA ' ' A' ' 135' ' ' LEU . 66.0 m-70 -118.6 125.99 50.98 Favored 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.752 -178.331 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.477 ' HB2' ' CE2' ' A' ' 128' ' ' PHE . 83.7 t80 -125.4 101.3 6.88 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.294 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -128.84 120.45 52.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.343 -177.404 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.5 t30 59.92 32.75 21.34 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.135 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 74.63 33.29 56.14 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.671 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -133.99 131.76 39.32 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.546 ' HA ' ' O ' ' A' ' 129' ' ' HIS . 6.1 mp -98.93 133.98 42.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.501 -176.424 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.447 ' HA ' ' CB ' ' A' ' 115' ' ' CYS . 21.0 m-85 -136.85 166.03 24.58 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.544 178.012 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 16.4 p -109.27 -168.45 1.34 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.913 0.387 . . . . 0.0 110.839 178.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -77.64 -26.71 50.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.472 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -73.55 -42.31 61.85 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.563 -175.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.94 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 0.6 OUTLIER -101.19 -2.17 32.0 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.469 -176.59 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 141' ' ' ARG . 32.0 ttt-85 -29.69 105.61 0.22 Allowed Pre-proline 0 N--CA 1.478 0.931 0 O-C-N 124.517 1.136 . . . . 0.0 113.336 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -79.06 88.78 1.42 Allowed 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 123.242 2.628 . . . . 0.0 112.301 178.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.52 -30.67 61.12 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.485 -0.779 . . . . 0.0 112.708 -176.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -75.08 -15.77 60.6 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -175.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 145' ' ' LEU . 1.0 OUTLIER -91.87 -22.39 20.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.818 0.342 . . . . 0.0 111.222 -175.95 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.561 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.562 -177.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 207' ' ' GLY . . . . . 0.414 ' HA3' ' CE1' ' A' ' 129' ' ' HIS . . . . . . . . 0 N--CA 1.447 -0.629 0 N-CA-C 111.066 -0.814 . . . . 0.0 111.066 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -116.2 169.52 9.22 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 173.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 50.9 mm -114.44 126.13 71.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 405' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 123' ' ' VAL . . . -66.87 134.87 94.09 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.909 -177.619 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 406' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 20.0 Cg_exo -67.01 -176.19 0.73 Allowed 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 123.082 2.521 . . . . 0.0 111.715 176.688 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 407' ' ' PHE . . . . . 0.48 ' HA ' ' HB3' ' A' ' 124' ' ' PRO . 27.6 m-85 -107.94 163.46 16.91 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.942 -179.164 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -54.35 116.78 3.3 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.551 2.167 . . . . 0.0 111.704 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.7 177.53 4.64 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.123 -176.216 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -116.6 121.81 42.79 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 174.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 411' ' ' ALA . . . . . 0.746 ' HB2' HG21 ' A' ' 100' ' ' VAL . . . -90.88 -141.35 0.17 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.875 0.369 . . . . 0.0 111.244 -176.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.602 ' HB3' ' HB2' ' A' ' 84' ' ' SER . 0.0 OUTLIER -90.96 113.25 57.49 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.136 -179.41 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 413' ' ' PRO . . . . . 0.72 ' HA ' ' O ' ' A' ' 94' ' ' ILE . 14.6 Cg_endo -57.77 151.04 58.59 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.997 2.465 . . . . 0.0 113.173 -178.38 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 3.2 m -71.17 129.82 39.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.265 -178.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.451 -0.386 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 174.086 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.395 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.587 HD23 ' H ' ' A' ' 80' ' ' LEU . 1.3 pt? -96.2 28.98 2.98 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.195 176.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.404 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.3 OUTLIER 52.64 74.69 0.27 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.99 -179.76 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 92.56 -125.63 8.21 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.222 -173.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.551 ' HA ' HD11 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -162.02 66.78 0.25 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.234 0.54 . . . . 0.0 110.4 178.914 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.38 -72.47 0.7 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.046 178.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -141.7 142.87 12.34 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 121.186 -0.531 . . . . 0.0 111.916 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -137.67 158.86 43.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.969 0.414 . . . . 0.0 110.91 -178.075 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.506 ' HB2' ' CE1' ' A' ' 109' ' ' HIS . 38.0 t -85.89 144.92 27.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.349 177.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.32 -4.0 58.6 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.882 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.422 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -117.11 -47.59 2.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.488 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 57.0 m -82.6 -40.64 20.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.852 0.358 . . . . 0.0 111.276 -179.28 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 85.57 9.16 79.23 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 110.814 -0.915 . . . . 0.0 110.814 -172.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.493 ' NE2' ' H ' ' A' ' 93' ' ' SER . 0.0 OUTLIER -93.88 164.7 13.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.366 -0.417 . . . . 0.0 109.953 179.213 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.493 ' H ' ' NE2' ' A' ' 92' ' ' GLN . 0.0 OUTLIER -82.03 171.28 14.57 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.059 0.457 . . . . 0.0 111.218 -179.831 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.763 HG12 HG11 ' A' ' 100' ' ' VAL . 2.6 mp -114.77 105.31 53.48 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.372 175.699 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -73.8 159.12 45.87 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.767 2.311 . . . . 0.0 112.076 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.52 ' HB2' ' HB3' ' A' ' 413' ' ' PRO . . . -71.91 -13.08 61.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.975 0.416 . . . . 0.0 111.118 -178.711 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.74 12.26 32.62 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.926 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -123.2 157.04 33.91 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.221 0.534 . . . . 0.0 110.718 -179.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.6 mt -114.68 130.03 56.76 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.314 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.763 HG11 HG12 ' A' ' 94' ' ' ILE . 13.2 m -129.66 168.06 23.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.773 -175.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -112.11 141.13 46.18 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.022 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.2 136.35 49.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.361 -178.372 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -150.97 121.83 7.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.684 -0.234 . . . . 0.0 110.998 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 70.2 -2.64 2.04 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.162 0.585 . . . . 0.0 111.733 176.3 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 115.83 -16.09 16.29 Favored Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -175.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -89.97 163.92 14.76 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -124.4 140.21 48.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.034 0.445 . . . . 0.0 111.669 -177.273 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' TYR . . . . . 0.549 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 98.2 m-85 -131.09 167.49 19.01 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.366 -0.833 . . . . 0.0 108.771 175.148 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.798 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 72.5 m80 -92.73 -159.14 0.65 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 176.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 5.0 mt -85.29 -22.0 28.75 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.994 0.426 . . . . 0.0 111.37 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.63 -35.61 14.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.939 0.4 . . . . 0.0 111.763 -176.067 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.798 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.5 -16.66 59.59 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.207 -175.678 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.66 64.53 6.41 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.397 177.481 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.684 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.6 OUTLIER -131.14 152.47 50.4 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.774 -179.67 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.472 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 5.0 t -64.23 132.21 49.63 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 175.797 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 3.4 m -82.27 2.47 31.83 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.548 -176.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -106.03 -49.38 3.39 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -176.157 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.527 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 28.2 p -112.04 -14.42 13.45 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.055 0.455 . . . . 0.0 110.654 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.472 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 73.8 23.81 2.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.287 -179.034 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ASN . . . . . 0.527 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 3.2 m-80 -65.88 133.63 51.33 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 170.837 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.684 ' HA ' HG22 ' A' ' 114' ' ' THR . 10.7 tpp85 -75.29 119.55 19.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.243 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.638 HD11 ' HB3' ' A' ' 135' ' ' LEU . 23.6 mt -58.89 137.19 57.93 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -115.27 132.38 23.09 Favored Pre-proline 0 C--N 1.321 -0.641 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.309 -165.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.47 ' HB2' ' CE2' ' A' ' 407' ' ' PHE . 19.9 Cg_endo -60.63 111.7 1.12 Allowed 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.628 2.219 . . . . 0.0 110.992 175.314 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 110.29 -4.48 29.89 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.604 -0.807 . . . . 0.0 112.045 -178.281 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.404 ' O ' ' HA ' ' A' ' 404' ' ' ILE . 1.0 OUTLIER -124.45 -177.76 3.9 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 177.203 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.521 ' HD2' ' HG3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -90.5 149.71 22.09 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.385 0.612 . . . . 0.0 112.348 -172.176 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.531 ' HB2' HD22 ' A' ' 122' ' ' LEU . 5.8 p90 -144.91 147.19 32.47 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.946 -1.025 . . . . 0.0 108.577 172.05 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -112.73 113.75 26.0 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.12 0.486 . . . . 0.0 110.973 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.488 ' CE2' ' HA2' ' A' ' 133' ' ' GLY . 3.8 t80 -92.66 101.1 13.5 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 175.324 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 28.1 mm -112.56 115.06 48.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.937 -176.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.5 t30 54.41 35.72 23.79 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 123.657 0.598 . . . . 0.0 111.288 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.488 ' HA2' ' CE2' ' A' ' 130' ' ' TYR . . . 80.24 30.11 42.88 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.938 177.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.417 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 0.7 OUTLIER -133.92 146.64 50.7 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.733 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.638 ' HB3' HD11 ' A' ' 122' ' ' LEU . 3.1 mt -95.37 118.98 33.08 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.865 0.364 . . . . 0.0 110.848 -177.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.417 ' CE2' ' HB2' ' A' ' 134' ' ' SER . 69.0 m-85 -126.85 159.66 33.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.939 176.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' CYS . . . . . 0.526 ' SG ' ' HB2' ' A' ' 140' ' ' ASP . 14.4 p -101.02 169.91 8.63 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.442 -178.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.521 ' HG3' ' HD2' ' A' ' 127' ' ' ARG . 1.5 mm-40 -77.9 -17.7 56.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.267 0.556 . . . . 0.0 110.264 174.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -20.76 58.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.622 0.725 . . . . 0.0 109.222 179.488 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.526 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 0.4 OUTLIER -104.07 -67.86 0.88 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.995 178.567 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 52.51 89.66 0.1 OUTLIER Pre-proline 0 N--CA 1.466 0.355 0 C-N-CA 123.468 0.707 . . . . 0.0 112.376 178.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -58.19 99.42 0.1 OUTLIER 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.047 2.498 . . . . 0.0 112.405 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.83 -26.64 63.37 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.96 -176.372 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.69 -39.84 95.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.774 -177.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.2 mt -152.28 90.87 1.54 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.501 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.476 ' H ' HG13 ' A' ' 146' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.956 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.952 0 N-CA-C 112.73 -0.148 . . . . 0.0 112.73 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -76.01 118.05 18.36 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 173.778 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 404' ' ' ILE . . . . . 0.404 ' HA ' ' O ' ' A' ' 126' ' ' ASP . 30.2 mm -81.54 138.95 18.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.938 -174.338 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -57.9 128.72 81.22 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.391 176.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 406' ' ' PRO . . . . . 0.606 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 38.1 Cg_endo -66.98 -5.46 13.56 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.383 2.722 . . . . 0.0 113.93 -174.131 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 407' ' ' PHE . . . . . 0.606 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 21.0 m-85 78.06 156.59 0.14 Allowed Pre-proline 0 N--CA 1.468 0.434 0 O-C-N 124.011 0.819 . . . . 0.0 109.935 -178.145 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.95 128.56 10.06 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.42 2.08 . . . . 0.0 112.203 176.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -140.44 177.21 8.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.585 176.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -86.29 125.63 33.74 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.784 0.326 . . . . 0.0 110.871 -179.462 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -91.92 -143.03 0.19 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.165 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 13.3 mt -85.35 116.55 66.01 Favored Pre-proline 0 N--CA 1.452 -0.369 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 177.065 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 413' ' ' PRO . . . . . 0.52 ' HB3' ' HB2' ' A' ' 96' ' ' ALA . 24.6 Cg_exo -63.75 154.82 67.18 Favored 'Trans proline' 0 C--O 1.237 0.453 0 C-N-CA 122.818 2.346 . . . . 0.0 112.84 -178.347 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.404 HG21 ' HB3' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -69.25 154.61 41.76 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.259 179.775 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.174 179.569 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.456 ' HB3' ' HB1' ' A' ' 86' ' ' ALA . 0.3 OUTLIER . . . . . 0 C--O 1.233 0.202 0 CA-C-O 121.534 0.683 . . . . 0.0 110.015 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.842 HD13 ' HA ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -121.56 113.71 20.17 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.607 -172.627 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -61.2 -35.56 77.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.32 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -124.3 26.43 5.79 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.149 -0.548 . . . . 0.0 111.963 179.268 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.842 ' HA ' HD13 ' A' ' 80' ' ' LEU . 2.7 t-20 69.41 161.73 0.21 Allowed 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.509 0.724 . . . . 0.0 112.801 178.143 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.447 ' N ' HD22 ' A' ' 80' ' ' LEU . 51.4 m 71.76 -61.15 0.5 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.008 -0.996 . . . . 0.0 113.46 174.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -89.23 122.2 6.36 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.547 -0.835 . . . . 0.0 113.22 -174.242 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.517 ' HA ' ' HA ' ' A' ' 93' ' ' SER . . . -168.29 133.42 1.76 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.578 0.228 . . . . 0.0 111.127 177.282 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.33 133.57 34.04 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 171.442 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.7 m -86.66 8.66 21.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.052 -0.522 . . . . 0.0 112.229 -172.014 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.722 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -98.17 -59.53 1.74 Allowed 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.082 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 26.1 p -86.42 -60.08 2.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.254 0.549 . . . . 0.0 110.609 -177.246 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.44 ' HA2' ' HE ' ' A' ' 79' ' ' ARG . . . 133.07 -2.8 4.79 Favored Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.739 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -82.19 122.24 27.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.902 0.382 . . . . 0.0 110.279 178.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.582 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.9 OUTLIER -63.13 128.03 33.96 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.809 172.833 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.442 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 1.7 mt -65.31 119.66 61.17 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.789 -174.266 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 94' ' ' ILE . 2.9 Cg_exo -76.88 166.9 26.17 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.25 2.633 . . . . 0.0 111.817 176.563 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.42 0.85 18.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.931 0.396 . . . . 0.0 111.499 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.18 21.39 14.22 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.875 179.522 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -135.88 160.31 38.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.739 179.019 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.1 mp -120.86 150.55 40.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.336 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.9 157.4 42.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.939 -178.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.0 126.78 52.6 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.078 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 102' ' ' ARG . 10.1 mtt-85 -91.48 97.77 11.27 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.412 ' HB2' ' CE1' ' A' ' 113' ' ' PHE . . . -64.68 -59.07 4.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.752 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.3 91.12 0.37 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.004 179.163 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 82.09 -52.69 4.66 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.012 -0.613 . . . . 0.0 112.292 -176.064 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -90.97 158.66 16.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.586 0.231 . . . . 0.0 111.285 -178.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -118.09 144.24 26.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.9 0.381 . . . . 0.0 111.072 -177.778 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -137.0 163.74 30.01 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.672 177.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.784 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 12.4 m80 -79.49 170.82 16.01 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.824 0.345 . . . . 0.0 110.773 -179.319 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.38 -31.61 72.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.821 177.709 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.535 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.48 -30.83 18.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.122 0.487 . . . . 0.0 110.551 178.609 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.784 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 34.0 m -79.0 -13.74 59.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.148 -178.131 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' PHE . . . . . 0.412 ' CE1' ' HB2' ' A' ' 103' ' ' ALA . 0.0 OUTLIER -76.18 76.03 3.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.091 174.053 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.576 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.7 OUTLIER -133.79 149.7 51.42 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.115 -178.425 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.444 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 5.5 p -74.53 155.16 38.22 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.142 0.496 . . . . 0.0 111.174 -179.376 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 1.5 m -79.68 -45.68 18.53 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.248 -175.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.74 -51.57 39.93 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -171.222 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.79 -14.65 16.53 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 121.051 -0.259 . . . . 0.0 111.196 -175.382 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.444 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 69.41 31.65 3.74 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.88 -176.819 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -83.4 146.96 28.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.639 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.576 ' HA ' HG22 ' A' ' 114' ' ' THR . 9.0 ttt180 -85.84 135.47 33.7 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.879 0.371 . . . . 0.0 111.313 -175.438 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.732 HD22 ' HB2' ' A' ' 128' ' ' PHE . 9.0 mt -81.75 125.71 30.96 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 38.6 t -122.56 138.38 29.21 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.621 -170.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.43 111.41 0.93 Allowed 'Trans proline' 0 N--CA 1.463 -0.277 0 C-N-CA 122.406 2.07 . . . . 0.0 111.072 174.044 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 114.34 -21.36 15.06 Favored Glycine 0 N--CA 1.446 -0.641 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 -173.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.47 176.02 5.49 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.468 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.746 ' HB2' ' HB2' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -102.46 135.83 43.38 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.703 0.287 . . . . 0.0 111.363 -173.807 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.732 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -132.52 159.6 38.95 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.027 179.322 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 129' ' ' HIS . . . . . 0.564 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 78.1 m-70 -130.09 140.58 50.8 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.774 0.321 . . . . 0.0 110.528 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.422 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 10.7 t80 -125.28 101.98 7.23 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 178.289 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 7.6 mt -121.84 111.33 30.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 120.732 0.301 . . . . 0.0 110.649 -176.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 51.7 t30 57.87 51.13 9.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.667 179.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.422 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 62.19 35.58 91.74 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.736 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 2.6 m -133.38 138.85 46.48 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -177.707 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 24.3 mt -92.67 125.34 37.25 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.975 -175.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.564 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 76.5 m-85 -129.43 161.96 29.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.055 176.566 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 137' ' ' CYS . . . . . 0.513 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 17.1 p -111.07 -176.14 2.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.953 0.406 . . . . 0.0 111.298 -175.655 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.746 ' HB2' ' HB2' ' A' ' 127' ' ' ARG . 0.0 OUTLIER -71.56 -32.94 68.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.871 176.661 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -68.11 -34.42 76.34 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 177.269 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.513 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.7 OUTLIER -66.35 -77.73 0.06 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.271 175.47 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 44.18 70.59 1.83 Allowed Pre-proline 0 CA--C 1.529 0.15 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.855 -176.554 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 142' ' ' PRO . . . . . 0.4 ' O ' HG22 ' A' ' 146' ' ' ILE . 8.9 Cg_exo -72.09 78.66 1.81 Allowed 'Trans proline' 0 C--O 1.236 0.394 0 C-N-CA 122.762 2.308 . . . . 0.0 111.786 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 18.4 m -57.79 -41.2 81.63 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.993 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -71.62 -24.28 61.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.945 0.402 . . . . 0.0 111.45 -177.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -79.79 -52.66 7.64 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.1 -178.116 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.426 ' O ' HG13 ' A' ' 146' ' ' ILE . 0.8 OUTLIER . . . . . 0 C--N 1.325 -0.494 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.728 -175.526 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.615 0 N-CA-C 111.98 -0.448 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.48 144.91 28.42 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.866 0.365 . . . . 0.0 110.811 -178.415 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 28.4 mm -79.43 141.74 14.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 177.324 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 405' ' ' ALA . . . . . 0.462 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -50.25 127.06 22.24 Favored Pre-proline 0 N--CA 1.462 0.128 0 O-C-N 123.289 0.368 . . . . 0.0 111.025 177.356 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 406' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 15.3 Cg_exo -69.45 10.29 0.46 Allowed 'Trans proline' 0 N--CA 1.475 0.44 0 C-N-CA 123.733 2.956 . . . . 0.0 114.023 -171.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 407' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 15.1 m-85 70.34 158.54 0.16 Allowed Pre-proline 0 N--CA 1.466 0.355 0 O-C-N 123.554 0.534 . . . . 0.0 111.741 176.023 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -83.89 149.38 12.4 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.647 2.232 . . . . 0.0 112.915 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -155.13 160.74 41.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.441 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -78.19 124.59 28.25 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 176.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -94.45 -139.48 0.23 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.288 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.1 OUTLIER -91.45 111.79 50.86 Favored Pre-proline 0 C--N 1.329 -0.286 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 175.396 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 413' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 28.8 Cg_exo -61.75 132.18 38.88 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.512 2.141 . . . . 0.0 112.16 -179.384 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.582 HG21 ' HB3' ' A' ' 93' ' ' SER . 1.0 OUTLIER -70.64 139.03 51.22 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.407 -179.22 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.469 0.517 0 C-N-CA 123.777 0.831 . . . . 0.0 111.845 177.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.0 ttt85 . . . . . 0 CA--C 1.521 -0.148 0 CA-C-O 121.31 0.576 . . . . 0.0 109.793 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.719 HD21 ' HA ' ' A' ' 83' ' ' ASN . 0.4 OUTLIER -154.76 -176.72 6.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.116 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -82.26 72.04 9.32 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.54 0.686 . . . . 0.0 110.067 176.52 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 125.29 -117.65 3.03 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.413 -178.02 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.719 ' HA ' HD21 ' A' ' 80' ' ' LEU . 1.4 t-20 -159.32 175.49 13.31 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 178.774 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 10.5 m 62.09 73.29 0.47 Allowed 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.88 0.737 . . . . 0.0 112.04 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLY . . . . . 0.505 ' HA3' HG22 ' A' ' 414' ' ' THR . . . 128.59 83.41 0.37 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.191 -1.004 . . . . 0.0 112.978 175.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.563 ' HB2' HD22 ' A' ' 80' ' ' LEU . . . -148.25 144.37 27.61 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.629 -0.336 . . . . 0.0 110.181 178.181 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 4.7 t -66.65 142.62 57.39 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.693 177.324 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.585 ' HB2' ' CE1' ' A' ' 108' ' ' TYR . 0.7 OUTLIER -95.13 8.37 43.21 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.677 174.637 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.706 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -118.42 -59.7 1.86 Allowed 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.622 -179.231 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.431 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 31.1 p -91.09 -73.97 0.52 Allowed 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.167 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.431 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 129.56 61.02 0.1 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.548 176.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -137.52 150.51 47.58 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.6 0.238 . . . . 0.0 110.374 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.0 119.71 14.62 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.972 176.554 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.5 mp -76.54 120.23 80.79 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.785 -174.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.43 ' HD2' ' HB3' ' A' ' 98' ' ' GLU . 5.7 Cg_exo -77.74 166.24 25.69 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.524 2.816 . . . . 0.0 111.778 173.461 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.23 -21.05 61.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.962 0.411 . . . . 0.0 110.982 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.42 -13.66 58.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.282 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.43 ' HB3' ' HD2' ' A' ' 95' ' ' PRO . 15.1 tt0 -106.38 121.08 43.53 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.038 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 21.2 mt -84.75 139.3 32.07 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.552 -178.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.449 ' O ' ' HA ' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -115.09 144.59 22.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.945 -178.229 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.439 ' SD ' ' HG ' ' A' ' 110' ' ' LEU . 0.0 OUTLIER -91.81 120.26 32.36 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.993 179.965 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.513 ' HD2' HG13 ' A' ' 107' ' ' VAL . 8.3 tpt180 -96.74 108.76 21.46 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.034 -177.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -82.34 -40.22 21.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.055 0.455 . . . . 0.0 110.152 175.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.469 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -174.34 -106.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.582 176.747 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.469 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -76.69 -30.19 56.57 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.603 -0.808 . . . . 0.0 111.719 176.805 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -89.38 159.48 17.3 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.714 0.292 . . . . 0.0 110.974 -176.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.513 HG13 ' HD2' ' A' ' 102' ' ' ARG . 0.1 OUTLIER -128.99 135.91 60.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.834 -179.738 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 108' ' ' TYR . . . . . 0.585 ' CE1' ' HB2' ' A' ' 88' ' ' SER . 74.3 m-85 -135.92 164.79 27.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.445 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.843 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 19.4 m80 -92.32 172.33 8.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.537 179.169 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.667 HD21 ' HG3' ' A' ' 408' ' ' PRO . 0.5 OUTLIER -65.15 -30.96 71.92 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.341 0.591 . . . . 0.0 110.665 175.232 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.443 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 2.4 pttt -90.11 -13.51 35.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.85 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.843 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 35.4 m -103.77 -20.76 13.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.126 -173.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' PHE . . . . . 0.529 ' HD1' ' HA ' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -64.85 98.27 0.27 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.269 177.669 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.595 HG22 ' HA ' ' A' ' 121' ' ' ARG . 2.8 p -147.7 160.88 42.21 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -178.271 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 9.1 p -83.89 153.18 24.13 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 120.815 0.341 . . . . 0.0 110.296 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.16 -16.12 59.25 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.308 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.76 -51.05 5.71 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -173.529 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.797 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -112.85 -15.63 12.87 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.771 -0.371 . . . . 0.0 111.322 -178.024 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 67.69 36.31 3.68 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 123.624 0.577 . . . . 0.0 110.161 -176.184 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -73.81 123.51 24.32 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 175.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.595 ' HA ' HG22 ' A' ' 114' ' ' THR . 1.4 mtm180 -74.78 106.46 6.33 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.884 0.374 . . . . 0.0 110.744 -175.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.625 HD22 ' HB2' ' A' ' 128' ' ' PHE . 2.7 mt -66.1 133.94 51.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.007 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 14.8 t -132.85 142.28 44.13 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.695 -171.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_exo -57.09 109.56 0.47 Allowed 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 121.86 1.706 . . . . 0.0 110.72 173.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 117.39 -13.56 13.63 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.561 -174.468 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -108.29 169.04 8.88 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 175.622 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.507 ' HB2' ' HB3' ' A' ' 138' ' ' GLU . 8.6 mtt85 -100.49 145.61 28.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.958 0.409 . . . . 0.0 111.374 -174.421 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.625 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.4 OUTLIER -148.34 171.94 15.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.883 -179.799 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 129' ' ' HIS . . . . . 0.452 ' CE1' ' HA2' ' A' ' 207' ' ' GLY . 1.7 m80 -140.92 139.62 34.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.042 0.449 . . . . 0.0 111.282 178.262 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.624 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 46.6 t80 -124.26 103.24 8.12 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.505 HD12 ' CD2' ' A' ' 136' ' ' PHE . 13.5 mt -115.56 105.35 18.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.258 -175.354 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 64.4 24.56 13.23 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.033 174.003 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.624 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 92.94 31.86 8.31 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.614 -179.316 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.14 138.93 45.55 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.481 HD23 ' HD1' ' A' ' 130' ' ' TYR . 21.9 mt -96.94 127.74 43.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.957 0.408 . . . . 0.0 111.643 -176.431 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.505 ' CD2' HD12 ' A' ' 131' ' ' ILE . 72.9 m-85 -135.0 160.9 36.84 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 173.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' CYS . . . . . 0.606 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 23.7 p -101.79 -171.76 2.03 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.193 0.521 . . . . 0.0 110.461 179.48 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.507 ' HB3' ' HB2' ' A' ' 127' ' ' ARG . 3.6 pt-20 -77.31 -21.44 53.49 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.176 177.193 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' HIS . . . . . 0.606 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 72.7 t60 -82.15 -40.84 21.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.485 -175.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.797 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 0.1 OUTLIER -103.24 9.84 37.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.224 -178.005 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 141' ' ' ARG . . . . . 0.424 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 15.1 ttp180 -43.9 110.84 1.03 Allowed Pre-proline 0 N--CA 1.468 0.456 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.217 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 142' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 6.3 Cg_exo -78.88 107.07 2.19 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 123.279 2.652 . . . . 0.0 112.2 -178.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 16.0 m -79.29 -20.41 48.09 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.166 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.92 -57.45 8.74 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 121.016 0.436 . . . . 0.0 110.462 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 1.7 mp -116.11 81.69 1.65 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.77 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.411 ' HB ' ' O ' ' A' ' 142' ' ' PRO . 1.4 tt . . . . . 0 C--N 1.322 -0.607 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.299 -174.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 207' ' ' GLY . . . . . 0.452 ' HA2' ' CE1' ' A' ' 129' ' ' HIS . . . . . . . . 0 N--CA 1.448 -0.554 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.88 134.86 56.87 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.049 0.452 . . . . 0.0 112.116 -173.349 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 43.4 mm -66.94 136.56 26.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.623 174.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -52.98 124.95 38.92 Favored Pre-proline 0 C--N 1.331 -0.226 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 176.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 406' ' ' PRO . . . . . 0.446 ' O ' ' HD1' ' A' ' 407' ' ' PHE . 78.7 Cg_exo -46.31 -82.67 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.576 2.85 . . . . 0.0 113.136 -172.606 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 407' ' ' PHE . . . . . 0.629 ' CD2' ' HD2' ' A' ' 408' ' ' PRO . 0.2 OUTLIER 169.8 150.64 0.14 Allowed Pre-proline 0 C--N 1.329 -0.293 0 C-N-CA 123.437 0.695 . . . . 0.0 109.181 177.054 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 408' ' ' PRO . . . . . 0.667 ' HG3' HD21 ' A' ' 110' ' ' LEU . 87.0 Cg_endo -85.69 129.7 3.61 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.443 2.096 . . . . 0.0 112.606 174.658 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -139.53 164.04 30.95 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 177.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -74.71 110.87 9.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.679 0.276 . . . . 0.0 110.441 179.117 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -84.2 -90.78 0.09 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.941 -176.515 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -131.4 130.79 22.63 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.564 -176.004 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.18 131.64 35.39 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.843 2.362 . . . . 0.0 111.328 173.462 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.505 HG22 ' HA3' ' A' ' 85' ' ' GLY . 68.1 p -110.01 169.22 8.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.871 -172.366 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.533 0.322 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.867 177.166 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 . . . . . 0 N--CA 1.452 -0.337 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.798 HD12 ' H ' ' A' ' 84' ' ' SER . 1.2 pt? -147.82 123.11 10.26 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.911 -1.04 . . . . 0.0 108.934 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -51.83 -60.02 3.65 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 123.622 0.576 . . . . 0.0 110.433 -175.604 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.72 124.44 8.02 Favored Glycine 0 N--CA 1.44 -1.068 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 168.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -65.01 87.51 0.06 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 117.069 0.434 . . . . 0.0 110.119 -179.006 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.798 ' H ' HD12 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -148.76 -58.68 0.22 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.402 -178.727 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLY . . . . . 0.43 ' H ' HG23 ' A' ' 414' ' ' THR . . . -150.57 163.29 29.57 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 121.035 -0.602 . . . . 0.0 111.858 179.149 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.634 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -167.11 162.19 15.15 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.95 143.92 26.09 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.54 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.99 14.44 6.16 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -172.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.614 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -112.01 -58.23 2.16 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 121.055 -0.258 . . . . 0.0 111.28 179.504 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.529 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 32.0 p -95.32 -72.85 0.61 Allowed 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.47 -175.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.529 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 130.65 6.78 3.62 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 111.751 -0.54 . . . . 0.0 111.751 -176.711 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -83.99 117.81 23.63 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 174.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.762 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.7 OUTLIER -62.59 124.28 20.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.703 -177.745 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.4 mt -64.85 111.33 5.57 Favored Pre-proline 0 C--N 1.329 -0.312 0 O-C-N 123.685 0.616 . . . . 0.0 112.119 -171.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.563 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 8.0 Cg_exo -73.63 168.15 25.49 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 123.064 2.509 . . . . 0.0 111.111 173.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.87 -0.49 11.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.868 0.366 . . . . 0.0 111.346 -178.248 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -116.59 13.25 15.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.009 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.563 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.6 OUTLIER -115.62 142.86 46.17 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.458 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.3 mp -109.64 138.74 45.56 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.291 -177.185 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -120.21 146.96 24.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.558 -178.166 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.489 ' SD ' ' HG3' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -94.98 113.01 24.67 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.864 179.434 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.51 ' H ' ' HG3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -91.25 102.68 15.39 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.721 -177.898 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -78.93 -35.26 43.61 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.299 0.571 . . . . 0.0 110.163 176.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -148.98 -128.72 0.05 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.323 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -91.19 10.07 75.91 Favored Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 110.988 -0.845 . . . . 0.0 110.988 172.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -120.14 143.81 48.0 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.188 -0.506 . . . . 0.0 109.837 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -113.72 140.8 32.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.296 0.57 . . . . 0.0 112.411 -173.503 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -131.37 160.69 34.31 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 172.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.849 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 21.7 m80 -83.05 170.39 14.9 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.823 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.464 ' HA ' ' SD ' ' A' ' 101' ' ' MET . 1.7 tp -66.96 -29.35 69.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.289 0.566 . . . . 0.0 109.9 174.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -89.24 -11.18 44.35 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.441 177.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.849 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 34.4 m -108.34 0.17 21.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.049 -176.197 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' PHE . . . . . 0.467 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.0 OUTLIER -86.04 59.99 5.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.373 0.606 . . . . 0.0 110.3 178.064 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.9 p -114.22 155.5 26.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.204 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.503 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 17.1 p -68.99 153.62 43.49 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.174 0.512 . . . . 0.0 110.487 177.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.79 7.44 30.44 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.483 -176.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.48 -51.09 2.82 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -176.762 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -115.31 -4.52 12.38 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.508 -177.064 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.441 HH11 ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 66.13 32.04 8.4 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.105 -177.062 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ASN . . . . . 0.426 ' HB3' ' HB3' ' A' ' 137' ' ' CYS . 58.2 t30 -79.45 124.17 28.22 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.347 177.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.432 ' HE ' ' HB3' ' A' ' 121' ' ' ARG . 1.5 ttp180 -78.87 121.82 25.32 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.725 0.298 . . . . 0.0 110.633 -178.573 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.556 HD13 ' HB2' ' A' ' 128' ' ' PHE . 1.9 mt -69.61 162.0 28.5 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.202 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.411 ' HA ' ' HD3' ' A' ' 124' ' ' PRO . 75.8 t -128.64 130.34 23.5 Favored Pre-proline 0 C--N 1.328 -0.331 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.685 -174.649 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 123' ' ' VAL . 36.3 Cg_exo -61.69 111.28 1.14 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.578 2.185 . . . . 0.0 110.81 174.676 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.11 -18.66 14.03 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.525 -176.594 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.471 ' O ' ' HA ' ' A' ' 404' ' ' ILE . 2.0 t70 -112.78 -168.91 1.38 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 177.623 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.45 ' HA ' ' O ' ' A' ' 208' ' ' SER . 0.0 OUTLIER -90.76 147.14 23.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.473 0.654 . . . . 0.0 112.246 -171.441 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.556 ' HB2' HD13 ' A' ' 122' ' ' LEU . 0.4 OUTLIER -145.33 159.77 42.54 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.711 -1.132 . . . . 0.0 108.566 175.274 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 129' ' ' HIS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 11.2 m-70 -126.62 122.48 35.14 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.104 0.478 . . . . 0.0 111.299 -178.261 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.439 ' CE2' ' HA2' ' A' ' 133' ' ' GLY . 11.0 t80 -124.97 101.27 6.97 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 173.435 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 12.3 mt -124.54 124.18 67.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.464 -176.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 60.9 29.47 19.03 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.864 178.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.439 ' HA2' ' CE2' ' A' ' 130' ' ' TYR . . . 75.18 35.27 49.41 Favored Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.563 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 15.6 m -137.0 146.29 45.15 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.9 mt -98.79 130.4 45.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.346 0.593 . . . . 0.0 111.698 -174.19 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.503 ' HA ' ' HB2' ' A' ' 115' ' ' CYS . 40.3 m-85 -130.77 163.44 27.31 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.543 172.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 137' ' ' CYS . . . . . 0.678 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 31.0 p -106.54 -173.36 2.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.087 0.47 . . . . 0.0 111.366 -175.509 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.94 -26.43 59.6 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.492 177.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -77.96 -36.43 49.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.591 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.678 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.2 OUTLIER -57.66 -68.32 0.25 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.876 -1.057 . . . . 0.0 111.142 178.035 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 43.16 71.39 1.45 Allowed Pre-proline 0 N--CA 1.465 0.313 0 O-C-N 123.979 0.799 . . . . 0.0 111.389 -177.432 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -49.96 121.73 7.94 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.769 2.313 . . . . 0.0 112.244 -177.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.88 4.12 51.8 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.655 -176.248 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -104.2 -63.51 1.2 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.795 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -111.76 113.72 26.26 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.819 0.342 . . . . 0.0 110.236 178.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.323 -0.56 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.065 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.54 0 N-CA-C 112.08 -0.408 . . . . 0.0 112.08 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 208' ' ' SER . . . . . 0.45 ' O ' ' HA ' ' A' ' 127' ' ' ARG . 0.1 OUTLIER -78.7 165.21 23.88 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 177.422 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 404' ' ' ILE . . . . . 0.471 ' HA ' ' O ' ' A' ' 126' ' ' ASP . 51.3 mm -87.31 130.84 36.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 405' ' ' ALA . . . . . 0.446 ' HB2' ' HB3' ' A' ' 128' ' ' PHE . . . -60.56 123.81 75.79 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.92 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 406' ' ' PRO . . . . . 0.467 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 31.6 Cg_exo -60.22 154.72 50.22 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.967 2.445 . . . . 0.0 112.465 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 407' ' ' PHE . . . . . 0.454 ' HA ' ' HD3' ' A' ' 408' ' ' PRO . 21.5 m-85 -87.25 148.24 44.32 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.989 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 408' ' ' PRO . . . . . 0.489 ' HG3' ' SD ' ' A' ' 101' ' ' MET . 9.9 Cg_exo -70.71 138.51 34.94 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.995 2.463 . . . . 0.0 112.089 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -143.14 177.55 8.31 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 177.366 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -93.53 110.74 22.31 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.861 0.363 . . . . 0.0 110.379 179.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -80.5 -91.9 0.05 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.741 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 14.1 tp -131.08 120.25 18.19 Favored Pre-proline 0 C--N 1.325 -0.458 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 178.476 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -62.12 121.28 9.25 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.221 1.948 . . . . 0.0 111.259 175.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.762 HG21 ' HB3' ' A' ' 93' ' ' SER . 6.5 m -75.62 153.74 37.09 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.459 -175.76 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.232 0.164 0 C-N-CA 123.478 0.711 . . . . 0.0 110.957 177.605 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.574 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.3 OUTLIER . . . . . 0 N--CA 1.463 0.222 0 CA-C-O 121.259 0.552 . . . . 0.0 109.827 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.785 HD13 ' HA ' ' A' ' 83' ' ' ASN . 0.1 OUTLIER -145.75 14.41 1.37 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.922 -178.668 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 49.65 -108.61 0.32 Allowed 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.973 -171.499 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.21 106.58 2.01 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 172.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.785 ' HA ' HD13 ' A' ' 80' ' ' LEU . 0.8 OUTLIER -47.02 113.96 0.76 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 122.795 0.438 . . . . 0.0 111.778 -176.248 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.11 -73.73 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.566 176.141 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -136.41 127.22 4.07 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.641 -0.79 . . . . 0.0 113.031 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.679 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -149.06 165.25 32.25 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 177.742 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.33 139.51 39.21 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -20.01 51.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.002 -171.145 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.801 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -77.79 -43.61 30.1 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.981 -0.288 . . . . 0.0 111.461 -174.196 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.422 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 26.9 p -103.21 -64.65 1.06 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.137 0.494 . . . . 0.0 110.36 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.574 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 118.11 45.81 0.48 Allowed Glycine 0 N--CA 1.443 -0.892 0 C-N-CA 120.932 -0.651 . . . . 0.0 111.733 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.42 145.21 48.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.864 0.364 . . . . 0.0 110.261 179.231 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.758 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.0 OUTLIER -67.86 143.03 55.92 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.641 176.766 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.6 mt -111.86 101.84 52.31 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.716 -178.087 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.38 168.45 22.87 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 123.234 2.623 . . . . 0.0 111.519 173.357 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.49 4.37 4.92 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -175.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -96.67 -17.94 20.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.297 0.57 . . . . 0.0 110.07 177.685 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -102.86 153.31 20.31 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.327 -174.592 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.552 HD23 ' HB2' ' A' ' 408' ' ' PRO . 1.0 OUTLIER -109.67 143.87 38.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.974 0.416 . . . . 0.0 110.921 -176.672 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 162.19 36.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.785 -179.482 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.49 113.66 23.12 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.972 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -104.68 117.16 33.4 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.647 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -79.27 -59.76 2.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.768 176.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.28 114.25 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.389 176.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.43 -70.14 3.01 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.257 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -89.85 152.73 21.12 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.822 0.344 . . . . 0.0 110.492 -179.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.6 p -119.88 145.5 26.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.345 -177.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -137.99 -175.56 4.14 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.781 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.886 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 26.3 m80 -106.38 -179.72 4.02 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.383 -0.228 . . . . 0.0 110.383 179.349 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.37 -41.96 88.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.132 0.491 . . . . 0.0 110.187 178.745 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.676 ' HE2' ' SG ' ' A' ' 112' ' ' CYS . 0.1 OUTLIER -80.02 -28.35 39.36 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.367 179.134 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.886 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 27.6 m -79.64 -16.32 56.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.182 -178.484 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' PHE . . . . . 0.579 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.0 OUTLIER -76.67 82.15 3.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.251 178.257 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.553 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.0 OUTLIER -136.35 158.24 44.9 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.131 -178.263 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.544 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 3.4 p -72.26 152.19 42.33 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 176.097 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 2.4 m -87.27 5.44 38.3 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -175.046 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -114.61 -50.63 2.78 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -176.037 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.753 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -115.11 6.99 15.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.809 0.338 . . . . 0.0 110.495 -177.959 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER 52.13 40.18 28.16 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.266 -179.074 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -81.33 130.13 34.91 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.558 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.553 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.6 OUTLIER -76.5 123.21 25.69 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.945 -175.918 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.516 HD13 ' HD2' ' A' ' 128' ' ' PHE . 4.6 mt -80.19 138.21 36.82 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.063 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -134.43 139.89 34.11 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.455 -174.629 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.455 ' HB3' ' CE2' ' A' ' 407' ' ' PHE . 52.8 Cg_exo -54.26 118.95 5.58 Favored 'Trans proline' 0 N--CA 1.463 -0.305 0 C-N-CA 122.575 2.183 . . . . 0.0 111.425 173.417 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 100.27 -0.27 55.89 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.53 -176.331 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -119.58 -173.35 2.51 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.727 0.299 . . . . 0.0 110.328 177.234 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -91.88 126.46 36.98 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.984 0.421 . . . . 0.0 111.166 -172.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.516 ' HD2' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -137.08 135.36 37.41 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 174.802 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -124.07 115.98 22.05 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.142 0.496 . . . . 0.0 111.13 -177.087 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.465 ' HB2' ' CZ ' ' A' ' 128' ' ' PHE . 6.2 t80 -103.47 101.41 11.3 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 178.064 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 4.6 mt -118.92 115.28 47.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.622 -176.602 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 3.3 m120 58.9 31.76 21.61 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.375 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.41 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 80.61 34.36 28.47 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.442 -0.885 . . . . 0.0 112.687 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.493 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 0.4 OUTLIER -139.69 140.17 36.78 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 -179.55 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.3 mt -91.1 122.23 33.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.073 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.544 ' HA ' ' HB2' ' A' ' 115' ' ' CYS . 70.6 m-85 -128.74 158.88 37.37 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.622 176.25 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' CYS . . . . . 0.711 ' SG ' ' HB2' ' A' ' 139' ' ' HIS . 8.5 p -114.08 -168.97 1.43 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.017 0.437 . . . . 0.0 111.35 -177.395 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.25 -22.47 48.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.053 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' HIS . . . . . 0.711 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 37.2 m-70 -78.16 -28.93 48.4 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 120.997 0.427 . . . . 0.0 110.574 -176.662 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.753 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 0.8 OUTLIER -123.02 29.04 6.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.471 -178.6 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 141' ' ' ARG . . . . . 0.432 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 45.0 ttt180 -51.55 111.19 2.21 Favored Pre-proline 0 N--CA 1.469 0.521 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.706 -178.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 1.0 OUTLIER -84.81 83.08 1.63 Allowed 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 123.366 2.71 . . . . 0.0 112.17 -178.78 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.8 -1.02 4.71 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -178.586 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -67.46 -17.34 64.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.799 0.333 . . . . 0.0 111.385 179.212 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.468 ' HB3' ' H ' ' A' ' 146' ' ' ILE . 3.9 tp -143.21 -102.37 0.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.685 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.468 ' H ' ' HB3' ' A' ' 145' ' ' LEU . 56.4 mt . . . . . 0 N--CA 1.465 0.304 0 CA-C-O 121.059 0.457 . . . . 0.0 111.292 -175.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.687 0 N-CA-C 110.974 -0.85 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 208' ' ' SER . . . . . 0.477 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 43.9 m -114.83 160.16 19.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.36 0.6 . . . . 0.0 111.311 -179.268 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 5.4 mm -111.57 138.16 41.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.357 178.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 405' ' ' ALA . . . . . 0.439 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -58.8 123.87 70.35 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-O 120.909 0.385 . . . . 0.0 111.532 -178.063 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 406' ' ' PRO . . . . . 0.579 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 31.4 Cg_exo -59.81 161.61 17.98 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.293 2.662 . . . . 0.0 112.491 177.738 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 407' ' ' PHE . . . . . 0.455 ' CE2' ' HB3' ' A' ' 124' ' ' PRO . 34.1 m-85 -94.77 156.46 38.19 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.481 -177.419 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 408' ' ' PRO . . . . . 0.552 ' HB2' HD23 ' A' ' 99' ' ' LEU . 50.5 Cg_endo -69.3 140.46 44.45 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.895 2.397 . . . . 0.0 112.752 179.302 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -144.82 175.78 9.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.516 178.432 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -98.08 109.74 22.44 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 174.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -85.77 -89.35 0.11 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.447 -175.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.482 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 2.1 tp -131.21 128.88 22.26 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.157 -178.021 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 413' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 3.2 Cg_exo -75.6 155.41 40.19 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.911 2.407 . . . . 0.0 111.913 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.758 HG21 ' HB3' ' A' ' 93' ' ' SER . 0.2 OUTLIER -83.06 176.5 9.18 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.772 177.055 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.179 177.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.451 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.1 OUTLIER . . . . . 0 CA--C 1.519 -0.227 0 CA-C-O 121.249 0.547 . . . . 0.0 110.329 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.754 HD11 ' H ' ' A' ' 84' ' ' SER . 1.5 pt? -98.86 155.31 17.45 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.597 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -73.22 -78.96 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.849 0.356 . . . . 0.0 111.077 -176.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -77.27 96.58 1.24 Allowed Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.473 -0.87 . . . . 0.0 111.17 175.379 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.473 ' HA ' HD11 ' A' ' 80' ' ' LEU . 58.4 t30 -56.41 100.69 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.229 0.537 . . . . 0.0 111.865 -174.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.754 ' H ' HD11 ' A' ' 80' ' ' LEU . 4.4 m -153.99 -62.15 0.13 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.708 175.53 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -141.73 118.56 1.34 Allowed Glycine 0 C--N 1.333 0.399 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.735 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.481 ' HB2' HD13 ' A' ' 80' ' ' LEU . . . -135.78 149.25 49.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.761 0.315 . . . . 0.0 110.424 179.144 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.888 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 3.3 t -57.18 145.93 29.77 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.262 177.275 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.5 m -99.63 -1.38 38.19 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.861 172.559 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.699 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -102.22 -59.26 1.73 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.014 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 30.7 p -93.98 -31.6 14.19 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 120.265 -0.574 . . . . 0.0 109.862 176.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.888 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 92.83 14.45 55.05 Favored Glycine 0 N--CA 1.45 -0.394 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.953 172.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -89.69 146.84 24.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.722 0.261 . . . . 0.0 110.759 178.866 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.464 ' HB2' HG21 ' A' ' 414' ' ' THR . 0.0 OUTLIER -66.08 140.31 58.24 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.457 176.984 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.7 mt -110.78 119.34 46.44 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -174.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -78.37 155.53 28.66 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.938 2.425 . . . . 0.0 110.628 167.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.797 ' HB2' ' HG3' ' A' ' 413' ' ' PRO . . . -68.07 -15.23 63.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.972 0.415 . . . . 0.0 111.116 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.94 -5.37 53.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.633 178.168 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -111.43 120.22 41.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.638 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.5 tp -76.1 128.53 35.18 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.968 0.413 . . . . 0.0 110.786 -178.083 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -116.59 140.02 40.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.335 -179.111 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.94 112.6 20.3 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.397 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.449 ' HD3' ' OE2' ' A' ' 409' ' ' GLU . 0.0 OUTLIER -88.42 150.46 23.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.175 -176.118 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -130.58 -134.78 0.21 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.331 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.73 69.75 3.14 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.093 0.473 . . . . 0.0 110.561 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 85.42 -25.79 6.14 Favored Glycine 0 N--CA 1.452 -0.275 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.435 179.544 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -89.35 156.14 18.9 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.734 0.302 . . . . 0.0 111.044 -177.003 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.29 132.59 67.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.791 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' TYR . . . . . 0.483 ' HD1' ' HB2' ' A' ' 89' ' ' ALA . 44.8 m-85 -128.15 171.28 12.07 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.332 176.412 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.959 ' H ' ' HB2' ' A' ' 112' ' ' CYS . 23.8 m80 -101.36 179.22 4.42 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 177.159 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.7 mt -62.34 -28.61 69.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.227 0.537 . . . . 0.0 110.698 177.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.512 ' HG3' ' H ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.06 -34.37 15.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.289 176.919 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.959 ' HB2' ' H ' ' A' ' 109' ' ' HIS . 4.2 m -78.78 -5.7 54.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.836 -175.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -96.38 66.0 2.37 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 172.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.576 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.5 OUTLIER -119.97 158.03 27.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.76 -178.95 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.559 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 5.6 t -62.61 152.5 34.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.292 173.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.2 m -87.1 -32.89 19.67 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.799 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -99.12 -51.59 3.79 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -174.006 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.461 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 8.3 p -90.23 -20.33 23.13 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.89 0.376 . . . . 0.0 110.116 178.537 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.559 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 69.52 25.28 5.4 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.844 175.201 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ASN . . . . . 0.461 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 5.1 m-80 -70.1 128.35 35.99 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 174.588 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.576 ' HA ' HG22 ' A' ' 114' ' ' THR . 9.7 ttp85 -65.64 116.99 7.45 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 176.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 19.9 mt -65.5 151.99 45.07 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.731 0.301 . . . . 0.0 110.345 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 90.7 t -123.47 131.31 24.3 Favored Pre-proline 0 C--N 1.325 -0.466 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.651 -171.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.455 ' HA ' ' HB3' ' A' ' 405' ' ' ALA . 27.0 Cg_endo -65.01 110.43 1.5 Allowed 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 121.814 1.676 . . . . 0.0 110.596 172.455 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.52 -17.05 14.15 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.415 -173.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -117.33 -161.18 0.8 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.82 150.34 27.9 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -169.29 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.538 ' O ' ' HB2' ' A' ' 208' ' ' SER . 0.0 OUTLIER -157.62 135.82 11.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.251 172.175 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -126.09 128.59 47.6 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.89 0.376 . . . . 0.0 110.574 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.405 ' HA ' ' O ' ' A' ' 134' ' ' SER . 9.8 t80 -124.81 102.56 7.62 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.836 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.782 HD13 ' HG2' ' A' ' 142' ' ' PRO . 2.6 mp -131.32 130.43 63.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 -179.731 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.51 32.14 20.42 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 123.463 0.477 . . . . 0.0 110.248 -179.337 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 64.87 36.09 92.68 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.523 -177.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.405 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.9 OUTLIER -131.62 147.85 52.56 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.464 -0.433 . . . . 0.0 109.884 -179.135 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 13.7 mt -101.26 115.06 29.63 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.322 -174.367 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -122.16 173.32 7.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.67 174.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' CYS . . . . . 0.772 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 29.4 p -119.09 -165.93 1.2 Allowed 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 177.678 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.09 -25.99 47.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.265 0.555 . . . . 0.0 109.51 175.051 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' HIS . . . . . 0.772 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 68.4 t60 -74.57 -24.34 58.9 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.256 -0.884 . . . . 0.0 108.738 176.726 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.535 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 1.7 m-20 -113.8 23.73 12.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.486 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 24.5 ttt-85 -62.88 115.14 15.13 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.125 -175.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' PRO . . . . . 0.782 ' HG2' HD13 ' A' ' 131' ' ' ILE . 44.9 Cg_exo -56.89 114.87 2.12 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.042 2.494 . . . . 0.0 112.645 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -18.25 56.95 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.762 -179.016 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -99.05 -98.88 0.22 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.251 -175.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.42 75.84 10.2 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.326 -176.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 5.4 tt . . . . . 0 C--N 1.324 -0.538 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 175.091 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.487 0 N-CA-C 111.634 -0.586 . . . . 0.0 111.634 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 208' ' ' SER . . . . . 0.538 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -120.66 138.66 53.82 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.947 0.403 . . . . 0.0 111.431 -178.849 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 35.5 mm -101.06 142.16 16.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.836 178.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 405' ' ' ALA . . . . . 0.455 ' HB3' ' HA ' ' A' ' 124' ' ' PRO . . . -52.9 136.52 46.48 Favored Pre-proline 0 C--O 1.233 0.218 0 CA-C-O 120.757 0.313 . . . . 0.0 111.209 177.588 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 406' ' ' PRO . . . . . 0.5 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 11.7 Cg_exo -72.17 2.17 5.24 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.521 2.814 . . . . 0.0 113.335 -174.537 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 407' ' ' PHE . . . . . 0.5 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 10.0 m-85 73.89 156.95 0.16 Allowed Pre-proline 0 N--CA 1.469 0.505 0 O-C-N 123.673 0.608 . . . . 0.0 111.395 178.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -83.71 136.02 7.1 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.882 2.388 . . . . 0.0 112.05 177.566 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 409' ' ' GLU . . . . . 0.449 ' OE2' ' HD3' ' A' ' 102' ' ' ARG . 1.0 OUTLIER -137.87 177.82 7.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.162 179.358 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -97.31 126.55 42.6 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.786 0.327 . . . . 0.0 110.626 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -94.84 -168.25 1.78 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.377 178.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.443 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.4 OUTLIER -71.86 128.62 89.22 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.394 179.708 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 413' ' ' PRO . . . . . 0.797 ' HG3' ' HB2' ' A' ' 96' ' ' ALA . 10.0 Cg_exo -72.2 130.42 16.4 Favored 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 122.959 2.439 . . . . 0.0 112.626 -175.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.475 ' HA ' ' HB2' ' A' ' 84' ' ' SER . 0.4 OUTLIER -79.29 161.18 26.45 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.1 178.122 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.535 0.386 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 . . . . . 0 C--O 1.228 -0.051 0 CA-C-O 121.003 0.43 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.677 ' HB2' ' HA ' ' A' ' 83' ' ' ASN . 0.8 OUTLIER -140.46 131.14 25.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.757 -177.867 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -81.1 104.41 11.57 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 176.606 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.43 5.43 86.99 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.468 -0.873 . . . . 0.0 111.892 -177.01 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.677 ' HA ' ' HB2' ' A' ' 80' ' ' LEU . 23.5 t-20 59.7 55.6 3.92 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.133 0.492 . . . . 0.0 111.434 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.41 ' HB2' ' N ' ' A' ' 415' ' ' SER . 29.1 m -157.96 107.4 2.09 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.415 175.507 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.36 133.29 1.79 Allowed Glycine 0 CA--C 1.519 0.328 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.824 178.19 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.43 ' HA ' ' HA ' ' A' ' 93' ' ' SER . . . -167.4 150.71 6.28 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 177.075 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.93 145.96 30.61 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.532 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.15 -10.76 59.06 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.08 -170.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.812 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -85.14 -46.91 10.66 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.164 -176.114 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.553 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 30.5 p -102.95 -77.35 0.56 Allowed 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.873 -178.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.553 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 147.33 -1.12 0.72 Allowed Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.742 -177.073 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -83.21 146.02 28.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.895 0.379 . . . . 0.0 110.181 177.383 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.43 ' HA ' ' HA ' ' A' ' 86' ' ' ALA . 1.2 m -76.48 169.09 18.91 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.159 176.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.7 mt -111.25 104.74 56.52 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-O 120.744 0.307 . . . . 0.0 111.244 -176.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.912 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 2.9 Cg_exo -76.29 167.75 25.22 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.853 2.369 . . . . 0.0 111.012 173.039 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.24 -9.01 51.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.06 0.457 . . . . 0.0 111.195 -178.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.31 -10.77 34.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.876 178.332 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.912 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 3.3 mm-40 -101.81 163.13 12.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.506 -179.333 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.559 ' HB2' HD12 ' A' ' 110' ' ' LEU . 10.3 mt -132.66 133.75 43.97 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.524 -178.335 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.406 HG12 ' HA ' ' A' ' 109' ' ' HIS . 2.0 m -118.21 148.97 20.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.828 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.64 121.97 37.91 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 175.844 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.406 ' HA ' HG12 ' A' ' 107' ' ' VAL . 14.4 ttt85 -88.52 129.21 35.52 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.47 -175.301 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -112.22 -147.93 0.42 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.59 77.79 2.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.934 0.397 . . . . 0.0 110.736 178.88 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.5 -42.39 2.7 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.857 -0.611 . . . . 0.0 112.603 176.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -89.7 156.24 18.68 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.838 0.351 . . . . 0.0 110.797 -178.198 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.406 HG12 ' HA ' ' A' ' 102' ' ' ARG . 0.4 OUTLIER -127.95 148.87 32.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.592 179.688 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -136.63 149.92 48.25 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 178.096 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.896 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 33.9 m80 -71.35 171.35 11.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.902 0.382 . . . . 0.0 110.798 -177.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.559 HD12 ' HB2' ' A' ' 99' ' ' LEU . 0.3 OUTLIER -61.26 -26.19 67.59 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.101 0.477 . . . . 0.0 111.171 175.971 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.417 ' HG2' ' H ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.82 -20.64 22.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.881 177.478 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.896 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 7.5 m -100.31 -18.65 16.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.184 -170.184 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -67.6 83.57 0.18 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.086 0.47 . . . . 0.0 110.201 176.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.574 HG22 ' HA ' ' A' ' 121' ' ' ARG . 2.5 p -135.67 160.63 37.91 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.528 -174.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.532 ' HB3' ' H ' ' A' ' 120' ' ' ASN . 37.2 t -60.88 154.18 22.86 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.626 177.455 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 1.2 m -95.64 -10.39 29.53 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.092 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -107.94 -52.48 2.76 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.839 -0.345 . . . . 0.0 111.815 -179.444 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.414 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -98.97 -20.09 16.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.11 0.481 . . . . 0.0 109.96 179.124 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.517 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.1 OUTLIER 64.94 37.54 6.91 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.891 -178.288 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ASN . . . . . 0.55 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 72.8 m-20 -75.53 140.95 43.05 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 174.394 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.574 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.1 OUTLIER -77.6 112.41 14.37 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 176.492 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.547 HD13 ' HB2' ' A' ' 128' ' ' PHE . 10.0 mt -70.7 152.46 43.81 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.362 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 8.9 t -119.09 135.04 23.65 Favored Pre-proline 0 C--N 1.325 -0.468 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.955 -168.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -56.99 111.59 0.85 Allowed 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 122.581 2.187 . . . . 0.0 111.207 174.264 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.59 5.9 56.6 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.513 -178.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -126.05 -173.95 2.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.757 0.313 . . . . 0.0 111.043 177.197 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.457 ' HA ' ' O ' ' A' ' 208' ' ' SER . 6.9 mmt-85 -73.86 136.64 43.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.383 0.611 . . . . 0.0 112.294 -171.131 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.547 ' HB2' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -148.84 153.28 37.86 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.966 -1.015 . . . . 0.0 108.578 175.517 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -135.45 133.62 38.76 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.492 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.406 ' HA ' ' O ' ' A' ' 134' ' ' SER . 5.1 t80 -126.17 102.11 7.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.378 175.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.47 HD12 ' HD2' ' A' ' 136' ' ' PHE . 2.8 mp -127.68 128.04 69.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 -178.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.5 m120 61.02 32.56 19.86 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.579 0.549 . . . . 0.0 111.016 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 68.07 35.27 83.4 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.436 -0.888 . . . . 0.0 112.037 -178.157 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.406 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.7 OUTLIER -138.41 146.91 42.77 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -178.253 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 9.6 mt -99.34 129.12 45.52 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.899 0.38 . . . . 0.0 110.617 -176.128 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.47 ' HD2' HD12 ' A' ' 131' ' ' ILE . 69.2 m-85 -129.44 161.24 30.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.501 179.4 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' CYS . . . . . 0.55 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 6.1 m -93.31 176.1 6.52 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.059 0.456 . . . . 0.0 109.831 175.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.95 -14.22 59.61 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 162.247 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' HIS . . . . . 0.46 ' HB3' ' HB2' ' A' ' 137' ' ' CYS . 67.8 t60 -70.11 -46.83 63.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.129 -1.396 . . . . 0.0 110.517 177.221 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.414 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 1.9 p-10 -109.83 13.52 23.54 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.281 -177.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 141' ' ' ARG . . . . . 0.447 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 22.2 ttt-85 -47.55 114.4 3.1 Favored Pre-proline 0 N--CA 1.468 0.445 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.998 -177.201 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 6.0 Cg_exo -79.85 118.92 3.86 Favored 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 123.286 2.657 . . . . 0.0 112.262 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -11.21 60.66 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -99.24 -18.61 17.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.949 0.404 . . . . 0.0 111.355 -179.511 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 1.2 mt -127.79 83.4 2.16 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.009 0.433 . . . . 0.0 110.31 -178.25 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.035 -179.105 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.459 0 N-CA-C 112.588 -0.205 . . . . 0.0 112.588 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 208' ' ' SER . . . . . 0.457 ' O ' ' HA ' ' A' ' 127' ' ' ARG . 0.0 OUTLIER -73.09 148.58 43.86 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.862 0.363 . . . . 0.0 110.599 178.731 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 48.3 mm -104.42 136.89 35.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.348 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -60.82 126.11 84.67 Favored Pre-proline 0 C--N 1.33 -0.261 0 O-C-N 123.42 0.45 . . . . 0.0 109.955 176.111 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 406' ' ' PRO . . . . . 0.552 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 82.9 Cg_exo -44.05 -71.06 0.06 OUTLIER 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.722 2.948 . . . . 0.0 113.133 -173.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 407' ' ' PHE . . . . . 0.552 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 0.2 OUTLIER 149.92 157.93 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.691 0 C-N-CA 125.185 1.394 . . . . 0.0 108.739 177.558 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 408' ' ' PRO . . . . . 0.532 ' HD2' ' CD2' ' A' ' 407' ' ' PHE . 39.7 Cg_exo -61.42 132.29 40.23 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.692 2.261 . . . . 0.0 112.05 174.258 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -138.4 154.38 48.91 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.956 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -86.73 130.84 34.32 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 176.217 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -107.38 -120.3 0.25 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.258 -177.334 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.426 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.2 OUTLIER -96.38 129.13 34.23 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.156 -179.217 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 413' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 20.7 Cg_exo -66.17 151.23 84.13 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 123.213 2.609 . . . . 0.0 112.771 -177.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 26.5 m -68.32 141.96 55.65 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.815 177.509 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 415' ' ' SER . . . . . 0.41 ' N ' ' HB2' ' A' ' 84' ' ' SER . 12.6 p . . . . . 0 N--CA 1.467 0.376 0 O-C-N 124.094 0.871 . . . . 0.0 111.704 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.7 ttp180 . . . . . 0 N--CA 1.454 -0.238 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.639 ' HB3' ' HA ' ' A' ' 83' ' ' ASN . 2.6 mm? -105.77 117.53 34.26 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 114.582 -1.19 . . . . 0.0 110.681 -173.056 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -70.36 -48.5 56.04 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.706 178.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -102.87 -12.8 31.19 Favored Glycine 0 N--CA 1.454 -0.155 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.203 178.398 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.639 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 1.4 t30 67.77 37.36 3.23 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.083 0.468 . . . . 0.0 111.243 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -116.16 -69.84 0.83 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.801 179.233 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLY . . . . . 0.459 ' O ' ' HA ' ' A' ' 93' ' ' SER . . . -133.64 143.42 15.1 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.983 -0.627 . . . . 0.0 111.999 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -147.88 170.77 16.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.708 0.254 . . . . 0.0 110.679 -177.339 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.665 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 50.4 t -75.01 145.77 42.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.567 179.144 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.7 m -80.93 -9.6 59.81 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.372 176.794 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -113.75 -58.01 2.21 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.802 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 37.7 m -71.19 -43.04 68.2 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.481 0.658 . . . . 0.0 109.972 178.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.665 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 87.2 0.28 85.21 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.586 -176.625 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.03 132.37 38.91 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.459 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 0.0 OUTLIER -57.89 123.38 15.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 175.917 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.453 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 8.0 mt -79.24 117.13 65.27 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.26 -176.294 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.538 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 2.7 Cg_exo -77.66 158.89 31.97 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 123.098 2.532 . . . . 0.0 111.271 174.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.713 ' HB2' ' HB3' ' A' ' 413' ' ' PRO . . . -66.37 -21.76 66.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.226 0.536 . . . . 0.0 111.001 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.96 2.39 30.95 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.509 -179.318 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.538 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -107.88 159.32 16.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.075 0.464 . . . . 0.0 110.904 -178.732 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.2 mt -121.42 124.66 45.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.574 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.551 ' HB ' ' O ' ' A' ' 108' ' ' TYR . 19.2 m -123.44 169.51 14.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.135 -173.761 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -115.77 112.26 21.75 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.22 0.533 . . . . 0.0 109.943 178.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.71 98.06 10.18 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.261 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -74.64 -45.37 45.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.504 178.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.434 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -161.53 -129.18 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -179.988 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.434 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -66.24 -22.37 70.88 Favored Glycine 0 N--CA 1.451 -0.326 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 173.099 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -89.15 135.37 33.6 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.621 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 2.5 p -123.12 128.24 74.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.442 -177.474 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' TYR . . . . . 0.551 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 38.7 m-85 -125.49 176.61 6.71 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.147 -179.346 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.79 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 70.4 m80 -99.42 -149.58 0.36 Allowed 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 175.762 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.425 ' H ' ' HG ' ' A' ' 110' ' ' LEU . 0.0 OUTLIER -86.87 -30.12 21.66 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.146 174.4 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.432 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.8 -34.02 16.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.797 0.332 . . . . 0.0 111.863 -172.239 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.79 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.1 OUTLIER -75.74 -19.4 59.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.261 0.553 . . . . 0.0 110.498 -176.402 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -76.41 72.31 3.13 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.412 176.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.635 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.1 p -137.79 157.95 45.37 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.453 -178.286 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.452 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 11.4 p -79.02 154.25 29.62 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 120.867 0.365 . . . . 0.0 110.247 176.875 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -53.78 18.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -174.128 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.6 -50.8 14.43 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -168.164 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.31 -13.58 19.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.595 0.236 . . . . 0.0 111.422 -175.249 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.452 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.9 OUTLIER 63.33 42.98 6.44 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.658 -179.389 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -77.99 122.7 25.88 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.408 176.376 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.635 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.0 OUTLIER -73.25 122.68 22.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.733 0.301 . . . . 0.0 110.683 179.802 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.491 HD22 ' HB2' ' A' ' 128' ' ' PHE . 8.9 mt -71.83 143.08 49.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 176.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.3 t -139.17 138.36 20.73 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-O 121.031 0.443 . . . . 0.0 111.568 -166.171 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.3 110.98 1.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.576 2.184 . . . . 0.0 110.865 175.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 120.77 -15.86 9.61 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 -175.584 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -113.72 -159.44 0.69 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.456 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 127' ' ' ARG . 0.0 OUTLIER -118.99 129.36 55.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.158 0.504 . . . . 0.0 111.444 -175.754 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.491 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.6 OUTLIER -117.53 138.64 51.76 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 172.538 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -104.88 108.98 20.76 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.93 0.395 . . . . 0.0 111.068 -177.126 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -95.77 100.86 12.52 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 174.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 57.1 mt -122.95 122.88 66.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.089 -175.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.4 t30 58.85 28.77 17.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.599 -176.395 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 73.38 32.66 59.68 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.34 -178.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 3.9 m -132.57 155.92 47.8 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 -177.683 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 67.3 mt -95.72 116.62 29.14 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 123.242 0.339 . . . . 0.0 110.821 -176.454 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -125.79 150.83 47.47 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.916 177.089 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' CYS . . . . . 0.563 ' SG ' ' HB2' ' A' ' 139' ' ' HIS . 17.8 p -99.47 -172.39 2.25 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.357 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -77.56 -20.83 53.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.873 0.368 . . . . 0.0 110.744 177.22 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' HIS . . . . . 0.563 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 1.0 OUTLIER -81.81 -38.82 24.95 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 178.252 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.484 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 2.0 m-20 -74.74 -31.24 61.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.586 178.697 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -20.79 101.88 0.07 OUTLIER Pre-proline 0 N--CA 1.47 0.538 0 O-C-N 125.294 1.621 . . . . 0.0 114.103 -177.033 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -70.74 162.61 41.98 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 122.901 2.401 . . . . 0.0 112.322 176.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 98.4 m -110.12 150.4 28.65 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.89 176.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . 73.94 -62.04 0.48 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.399 0.679 . . . . 0.0 111.607 178.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.62 62.29 7.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.094 0.473 . . . . 0.0 110.206 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.516 ' H ' HG13 ' A' ' 146' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.578 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.311 178.173 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.645 0 N-CA-C 111.868 -0.493 . . . . 0.0 111.868 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.09 162.74 34.21 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 -177.811 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 404' ' ' ILE . . . . . 0.426 ' O ' ' HD1' ' A' ' 128' ' ' PHE . 15.4 mm -125.05 -94.03 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 O-C-N 123.292 0.37 . . . . 0.0 110.067 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 405' ' ' ALA . . . . . 0.439 ' HA ' ' CD1' ' A' ' 128' ' ' PHE . . . -169.9 157.34 6.25 Favored Pre-proline 0 C--O 1.234 0.244 0 N-CA-C 110.41 -0.219 . . . . 0.0 110.41 -177.224 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 406' ' ' PRO . . . . . 0.496 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 73.6 Cg_endo -77.76 -19.3 12.78 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.293 1.995 . . . . 0.0 111.318 174.808 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 407' ' ' PHE . . . . . 0.496 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 4.4 m-85 76.17 149.93 0.13 Allowed Pre-proline 0 CA--C 1.533 0.312 0 O-C-N 124.419 1.074 . . . . 0.0 111.381 177.626 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.38 116.54 4.35 Favored 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.564 2.176 . . . . 0.0 112.646 178.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -136.8 177.31 7.96 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.927 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -89.58 134.33 34.18 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.144 -179.069 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -107.21 -166.38 1.15 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.429 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 2.4 mp -67.64 122.49 83.65 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.321 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 413' ' ' PRO . . . . . 0.713 ' HB3' ' HB2' ' A' ' 96' ' ' ALA . 7.0 Cg_exo -72.92 135.85 24.05 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 123.088 2.525 . . . . 0.0 113.04 -175.013 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -67.08 153.39 43.78 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.601 176.06 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.463 0.187 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.673 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.163 0 CA-C-O 121.337 0.589 . . . . 0.0 110.085 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.631 ' HG ' ' HB2' ' A' ' 86' ' ' ALA . 5.1 mp -99.53 14.42 29.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.72 -173.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.561 ' HB2' ' OG ' ' A' ' 93' ' ' SER . 0.2 OUTLIER 47.58 56.25 7.31 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 123.624 0.578 . . . . 0.0 112.184 176.322 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.33 5.2 59.34 Favored Glycine 0 C--N 1.327 0.046 0 C-N-CA 120.429 -0.891 . . . . 0.0 111.981 -178.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.467 ' HA ' ' CB ' ' A' ' 80' ' ' LEU . 61.3 t30 69.24 65.49 0.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 123.68 0.792 . . . . 0.0 112.285 175.681 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.526 ' CB ' ' HA ' ' A' ' 414' ' ' THR . 0.1 OUTLIER -106.36 -55.28 2.35 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.981 173.382 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -162.95 167.36 37.3 Favored Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.631 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . . . -153.31 135.16 14.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.71 0.29 . . . . 0.0 110.661 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.445 ' HB2' ' CE1' ' A' ' 109' ' ' HIS . 19.0 t -67.4 145.43 55.04 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.336 175.471 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.7 m -79.11 -0.14 30.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.356 178.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.531 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -124.95 -55.78 1.58 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.68 -0.236 . . . . 0.0 111.188 176.528 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 25.4 m -76.37 -26.67 55.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.786 0.327 . . . . 0.0 111.137 -178.367 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.25 32.68 84.59 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.287 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.413 ' O ' ' HA ' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -119.63 162.5 18.87 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.631 0.253 . . . . 0.0 110.406 179.831 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.561 ' OG ' ' HB2' ' A' ' 81' ' ' PHE . 0.7 OUTLIER -78.64 171.09 15.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.998 -178.684 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.705 HG12 HG11 ' A' ' 100' ' ' VAL . 2.3 mp -127.44 119.68 21.84 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.058 -175.326 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.666 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 7.8 Cg_exo -74.11 167.53 26.96 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.817 2.345 . . . . 0.0 111.12 171.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.4 -12.4 61.39 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.086 0.469 . . . . 0.0 111.183 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.98 -14.03 34.88 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.168 -179.007 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.666 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -94.92 102.7 14.55 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.032 0.444 . . . . 0.0 110.966 -174.445 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.418 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 62.5 mt -71.66 126.59 30.1 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 173.922 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.705 HG11 HG12 ' A' ' 94' ' ' ILE . 13.8 m -122.25 149.11 25.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.094 -174.694 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.28 153.75 21.76 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.901 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.66 155.46 49.67 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.701 -178.054 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -124.38 -113.4 0.3 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.019 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -92.68 75.46 5.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.111 0.481 . . . . 0.0 110.688 -178.389 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.82 -39.12 3.09 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.748 178.548 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -89.74 167.22 13.05 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.671 0.272 . . . . 0.0 110.92 -178.267 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 2.5 m -124.0 160.99 27.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 121.356 0.598 . . . . 0.0 112.588 -173.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' TYR . . . . . 0.651 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 73.7 m-85 -139.32 -170.26 2.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.654 -1.157 . . . . 0.0 107.977 173.769 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.831 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 71.7 m80 -112.29 -155.06 0.56 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 173.565 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -84.36 -25.31 29.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.139 0.495 . . . . 0.0 110.875 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.21 -32.84 16.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.084 -175.069 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.831 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -84.63 -16.34 42.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.655 -172.241 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -78.25 65.09 3.52 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.457 0.646 . . . . 0.0 110.624 179.239 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.673 HG22 ' HA ' ' A' ' 121' ' ' ARG . 12.1 p -121.35 164.52 16.93 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.892 -178.193 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.746 ' HB3' ' H ' ' A' ' 120' ' ' ASN . 41.3 t -60.24 152.74 24.02 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.203 172.87 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.97 -14.77 20.42 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.719 178.675 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.98 -50.94 4.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.594 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.56 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -106.63 -11.26 15.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.189 -178.35 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.621 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 61.61 36.2 16.85 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.592 -178.041 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ASN . . . . . 0.746 ' H ' ' HB3' ' A' ' 115' ' ' CYS . 0.8 OUTLIER -80.44 130.46 35.17 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 176.712 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.673 ' HA ' HG22 ' A' ' 114' ' ' THR . 1.6 ttp85 -76.29 117.83 18.37 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.887 0.375 . . . . 0.0 110.602 -177.515 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.4 mt -66.39 150.81 48.34 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.757 -177.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 11.7 t -131.77 140.95 39.86 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.066 -171.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -56.21 111.03 0.66 Allowed 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.375 2.05 . . . . 0.0 111.074 172.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.33 -19.58 13.04 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 -174.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -100.76 167.5 10.27 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 2.2 mtm-85 -106.52 145.89 31.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.02 0.438 . . . . 0.0 111.776 -173.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -129.11 149.24 51.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.861 174.6 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' HIS . . . . . 0.547 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 87.8 m-70 -117.06 109.26 16.75 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.535 -177.759 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.48 ' HA ' ' O ' ' A' ' 134' ' ' SER . 1.6 t80 -92.7 102.22 14.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.066 0.46 . . . . 0.0 109.846 178.397 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 12.0 mt -123.13 122.66 66.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.874 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 62.3 26.47 15.83 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.665 0.603 . . . . 0.0 111.086 178.131 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 78.28 34.19 37.51 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.229 -179.499 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.48 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.4 OUTLIER -139.0 152.73 47.88 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -177.859 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.3 mt -102.39 114.08 27.96 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.481 -174.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.547 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 64.9 m-85 -109.44 150.51 27.99 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 174.298 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' CYS . . . . . 0.473 ' HB3' ' HB2' ' A' ' 115' ' ' CYS . 11.4 p -114.47 176.13 5.18 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.393 -176.648 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -68.22 -17.53 64.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.308 -175.334 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' HIS . . . . . 0.405 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 26.7 t60 -75.18 -45.94 37.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.114 -176.548 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.56 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 10.2 p-10 -93.17 -39.48 11.0 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.069 -177.646 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 24.24 84.86 0.12 Allowed Pre-proline 0 N--CA 1.477 0.911 0 O-C-N 124.507 1.13 . . . . 0.0 113.761 176.209 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.38 134.29 63.38 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.767 2.311 . . . . 0.0 112.879 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.6 m -104.7 -25.71 12.58 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.102 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -68.63 -50.78 48.69 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.899 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.08 102.09 5.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.63 178.184 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 2.3 tt . . . . . 0 C--N 1.323 -0.544 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.982 178.43 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.54 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.22 140.92 38.91 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.036 0.446 . . . . 0.0 111.274 -175.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 26.7 mm -71.55 146.89 11.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 172.562 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 405' ' ' ALA . . . . . 0.433 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -48.28 117.53 5.85 Favored Pre-proline 0 C--N 1.33 -0.26 0 O-C-N 123.313 0.383 . . . . 0.0 110.509 176.777 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 406' ' ' PRO . . . . . 0.459 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 14.6 Cg_exo -69.85 8.13 0.86 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.748 2.965 . . . . 0.0 113.732 -172.379 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 407' ' ' PHE . . . . . 0.459 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 33.2 m-85 71.07 159.71 0.16 Allowed Pre-proline 0 C--O 1.234 0.252 0 O-C-N 123.76 0.663 . . . . 0.0 111.248 178.746 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 408' ' ' PRO . . . . . 0.418 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 2.9 Cg_exo -76.28 132.05 13.4 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.791 2.327 . . . . 0.0 111.787 175.27 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.32 177.25 7.83 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.823 178.894 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -85.89 142.27 28.98 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.271 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 411' ' ' ALA . . . . . 0.485 ' HB2' HG21 ' A' ' 100' ' ' VAL . . . -103.4 -134.15 0.32 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.778 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.467 HD13 ' HA ' ' A' ' 412' ' ' LEU . 1.1 mm? -100.17 124.99 41.29 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 178.414 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 413' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 34.2 Cg_exo -58.79 150.67 69.59 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 123.077 2.518 . . . . 0.0 112.705 179.223 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.526 ' HA ' ' CB ' ' A' ' 84' ' ' SER . 0.3 OUTLIER -67.67 149.78 49.57 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.297 -178.261 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 CA--C 1.531 0.233 0 CA-C-O 121.362 0.601 . . . . 0.0 112.134 179.733 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.715 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--O 1.227 -0.13 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.71 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.4 OUTLIER -126.79 169.13 13.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.71 0.29 . . . . 0.0 110.982 -176.538 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 -88.34 114.23 24.75 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.214 -178.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.482 ' HA3' ' CB ' ' A' ' 415' ' ' SER . . . 102.54 -33.92 6.15 Favored Glycine 0 C--N 1.33 0.247 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 -177.113 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ASN . . . . . 0.426 ' HA ' ' CD2' ' A' ' 80' ' ' LEU . 2.3 t30 67.22 83.82 0.16 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 172.747 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.656 ' H ' HD11 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -139.68 -43.06 0.44 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.153 173.446 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLY . . . . . 0.471 ' O ' HG21 ' A' ' 414' ' ' THR . . . -167.76 140.33 6.18 Favored Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 111.114 -0.794 . . . . 0.0 111.114 178.141 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.71 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -141.18 164.91 28.98 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 117.005 0.403 . . . . 0.0 111.488 -174.342 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.704 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 37.7 t -65.41 144.49 57.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.357 176.62 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.82 -15.97 61.62 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.007 178.685 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.439 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -111.21 -59.35 1.98 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.636 -0.257 . . . . 0.0 111.257 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 10.5 m -74.32 -43.61 56.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.35 0.595 . . . . 0.0 110.729 -179.297 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.715 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 81.62 12.58 81.49 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.962 -176.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -75.99 148.29 38.19 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.867 0.365 . . . . 0.0 110.854 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.508 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -69.55 129.27 39.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.9 176.147 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.5 mt -94.05 108.75 37.65 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-O 120.963 0.411 . . . . 0.0 111.048 -178.548 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.687 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 9.5 Cg_exo -72.76 167.19 27.87 Favored 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.772 2.314 . . . . 0.0 111.673 175.741 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.627 ' HB2' ' HB3' ' A' ' 413' ' ' PRO . . . -74.96 -3.76 34.18 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.995 0.426 . . . . 0.0 111.383 -179.211 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.31 -4.03 30.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.654 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.687 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.3 OUTLIER -94.11 123.4 37.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.304 -174.462 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.6 mt -89.45 114.7 26.22 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 173.243 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -115.82 141.9 31.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.275 -171.194 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.507 ' HA ' ' HA ' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -82.61 111.39 18.54 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.632 -177.623 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.461 ' H ' ' HG3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -111.52 127.4 55.7 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.104 -176.538 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.4 ' HA ' ' HG3' ' A' ' 406' ' ' PRO . . . -72.56 -39.15 67.68 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.067 0.461 . . . . 0.0 110.083 176.819 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.516 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 1.8 tp-100 -171.73 -100.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.656 -179.111 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLY . . . . . 0.516 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -83.97 -17.98 64.16 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.934 -0.65 . . . . 0.0 111.724 177.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -101.99 149.4 24.27 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 9.7 p -122.7 148.45 26.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.221 -173.354 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -139.69 -170.25 2.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.656 177.08 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.761 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 69.1 m80 -114.17 -161.59 0.77 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 173.776 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.3 mp -85.35 -19.43 31.46 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.235 0.541 . . . . 0.0 111.037 179.342 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.498 ' HA ' ' NH1' ' A' ' 121' ' ' ARG . 0.0 OUTLIER -90.16 -38.41 13.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.436 -176.105 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.761 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.56 -28.29 56.21 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.366 -174.182 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.45 82.23 0.79 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.038 -179.429 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.9 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.1 p -143.97 161.05 39.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.199 -176.319 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.565 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 1.7 t -67.62 142.23 56.5 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 173.59 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.98 -11.88 51.87 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.869 0.366 . . . . 0.0 111.091 -177.592 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.489 ' HB ' ' OD2' ' A' ' 140' ' ' ASP . 0.2 OUTLIER -91.62 -51.01 5.46 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -174.813 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.618 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 22.2 p -115.83 -7.42 12.05 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.886 0.374 . . . . 0.0 110.73 -178.245 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.565 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 70.99 27.4 3.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.981 -177.065 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ASN . . . . . 0.618 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 3.7 t-20 -54.2 119.24 4.85 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.241 172.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.9 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.0 OUTLIER -69.39 108.24 3.65 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 177.277 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.713 HD22 ' HB2' ' A' ' 128' ' ' PHE . 40.4 mt -63.46 137.58 58.2 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -179.082 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 53.9 t -122.59 132.0 24.32 Favored Pre-proline 0 C--N 1.323 -0.573 0 C-N-CA 121.004 -0.279 . . . . 0.0 110.601 -172.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.44 110.88 0.78 Allowed 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.285 1.99 . . . . 0.0 110.638 173.27 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 110.45 -13.05 30.61 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.604 -175.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -108.0 172.43 6.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.762 0.315 . . . . 0.0 110.293 178.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.723 ' HB3' ' HB3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -79.15 138.24 37.81 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.056 -174.268 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.713 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -146.8 160.08 42.71 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.051 176.108 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 129' ' ' HIS . . . . . 0.506 ' HB3' HD11 ' A' ' 131' ' ' ILE . 8.3 m-70 -127.31 134.72 49.98 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.035 0.445 . . . . 0.0 111.035 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.563 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 12.9 t80 -124.22 103.21 8.11 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -179.783 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.514 HD12 HD12 ' A' ' 146' ' ' ILE . 0.0 OUTLIER -121.75 117.54 52.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.345 -179.635 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 52.7 t30 57.1 35.87 26.87 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.77 0.669 . . . . 0.0 110.842 177.425 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.563 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 75.21 35.53 48.42 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.617 -0.802 . . . . 0.0 113.109 179.494 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -130.75 139.17 50.23 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 117.126 0.463 . . . . 0.0 110.136 179.099 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.421 ' HB3' HD11 ' A' ' 122' ' ' LEU . 10.7 mt -94.55 116.14 28.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.081 0.467 . . . . 0.0 110.924 -177.19 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -125.69 159.76 31.43 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.307 177.096 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' CYS . . . . . 0.478 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 21.2 p -91.6 173.08 8.07 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 177.988 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.723 ' HB3' ' HB3' ' A' ' 127' ' ' ARG . 0.3 OUTLIER -74.76 -14.68 60.74 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 175.535 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 139' ' ' HIS . . . . . 0.478 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 15.4 t60 -84.46 -24.19 29.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.517 -177.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.489 ' OD2' ' HB ' ' A' ' 117' ' ' THR . 40.3 m-20 -120.77 17.88 11.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.349 -176.608 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' ARG . . . . . 0.473 ' O ' ' HG3' ' A' ' 141' ' ' ARG . 4.5 ptm180 -53.67 120.81 24.42 Favored Pre-proline 0 C--O 1.235 0.305 0 CA-C-O 121.341 0.591 . . . . 0.0 111.307 -176.613 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 142' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 24.3 Cg_exo -64.13 128.99 23.01 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.908 2.405 . . . . 0.0 112.034 -179.103 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -98.06 -33.93 10.98 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.318 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -96.61 14.63 24.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.452 0.644 . . . . 0.0 110.471 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -146.0 55.93 1.18 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.603 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 146' ' ' ILE . . . . . 0.514 HD12 HD12 ' A' ' 131' ' ' ILE . 7.0 tt . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.39 -176.448 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.647 0 N-CA-C 112.343 -0.303 . . . . 0.0 112.343 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 208' ' ' SER . . . . . 0.408 ' O ' ' HA ' ' A' ' 127' ' ' ARG . 0.4 OUTLIER -90.14 174.88 7.38 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 177.997 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 49.7 mm -104.62 136.16 39.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.287 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -61.37 124.2 79.66 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.764 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 406' ' ' PRO . . . . . 0.4 ' HG3' ' HA ' ' A' ' 103' ' ' ALA . 11.5 Cg_endo -57.14 150.85 54.49 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.885 2.39 . . . . 0.0 112.373 178.647 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -86.03 155.32 58.08 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.321 -174.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 408' ' ' PRO . . . . . 0.507 ' HA ' ' HA ' ' A' ' 101' ' ' MET . 64.6 Cg_endo -76.49 117.41 4.56 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.586 2.191 . . . . 0.0 112.054 175.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -127.44 166.86 17.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.792 -178.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -74.77 109.92 8.64 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 176.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -89.83 -83.78 0.24 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.229 -174.361 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 412' ' ' LEU . 1.3 pt? -131.47 129.81 22.31 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.784 -176.034 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 413' ' ' PRO . . . . . 0.627 ' HB3' ' HB2' ' A' ' 96' ' ' ALA . 73.8 Cg_endo -80.68 121.18 4.08 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.509 2.139 . . . . 0.0 111.164 172.726 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.471 HG21 ' O ' ' A' ' 85' ' ' GLY . 32.4 p -93.47 -126.67 0.1 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -176.508 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 415' ' ' SER . . . . . 0.482 ' CB ' ' HA3' ' A' ' 82' ' ' GLY . 0.3 OUTLIER . . . . . 0 C--N 1.324 -0.522 0 CA-C-O 121.017 0.437 . . . . 0.0 111.767 -176.428 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.607 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER . . . . . 0 CA--C 1.522 -0.123 0 CA-C-O 121.061 0.458 . . . . 0.0 110.189 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.79 109.3 9.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.707 179.321 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -78.16 93.89 4.64 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.483 0.659 . . . . 0.0 110.462 -177.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.527 ' HA3' ' HA ' ' A' ' 415' ' ' SER . . . 123.45 -20.11 7.47 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.073 -175.236 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 64.14 18.94 11.55 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.548 0.739 . . . . 0.0 112.302 176.236 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.406 ' OG ' ' HA ' ' A' ' 414' ' ' THR . 0.2 OUTLIER -91.74 -14.09 30.52 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.848 176.947 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 151.43 170.14 17.92 Favored Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.001 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -167.93 163.81 13.83 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 178.369 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.607 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 43.3 t -68.5 145.78 53.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.058 0.456 . . . . 0.0 110.111 175.284 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -94.74 -1.71 52.44 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.793 179.11 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.45 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -112.41 -51.68 2.83 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.866 0.365 . . . . 0.0 110.338 177.552 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 34.8 m -77.78 -52.89 8.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.843 175.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.607 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 96.82 1.76 59.9 Favored Glycine 0 N--CA 1.443 -0.845 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.768 -176.768 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.6 134.88 34.38 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 177.433 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' SER . . . . . 0.738 ' HB3' HG21 ' A' ' 414' ' ' THR . 1.0 OUTLIER -65.69 148.3 51.98 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.16 176.735 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.8 mt -103.37 116.18 62.56 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -168.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -77.53 167.28 24.55 Favored 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.833 2.355 . . . . 0.0 111.028 170.011 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.08 7.27 6.41 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -176.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.67 -35.67 14.81 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -175.836 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -96.49 127.32 42.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.881 0.372 . . . . 0.0 110.785 -176.305 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.608 HD23 ' HB2' ' A' ' 408' ' ' PRO . 0.8 OUTLIER -79.69 125.2 29.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.64 176.486 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.834 HG21 ' HB2' ' A' ' 411' ' ' ALA . 29.8 m -115.91 -172.48 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.244 -170.559 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.8 mmt -122.59 112.7 18.31 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.005 0.431 . . . . 0.0 110.057 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -109.44 119.89 40.83 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.36 -178.202 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -96.63 -171.8 2.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.1 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.58 63.88 4.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.367 0.603 . . . . 0.0 110.085 177.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 168.76 -102.32 0.18 Allowed Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.339 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -95.75 178.11 5.56 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.875 0.369 . . . . 0.0 110.729 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 9.6 p -123.76 143.46 36.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.221 0.534 . . . . 0.0 111.659 -174.083 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' TYR . . . . . 0.779 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 41.1 m-85 -127.76 -172.84 2.77 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 174.57 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' HIS . . . . . 0.878 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 73.1 m80 -97.76 -164.53 1.15 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 172.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.6 pp -82.15 -23.57 35.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.895 0.379 . . . . 0.0 111.437 -178.199 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.427 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.56 -31.03 16.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.075 -175.343 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.878 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -78.79 -5.93 54.63 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.82 -176.342 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.33 76.6 1.86 Allowed 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.413 0.625 . . . . 0.0 110.5 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' THR . . . . . 0.665 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.7 OUTLIER -140.7 155.78 46.39 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.801 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 115' ' ' CYS . . . . . 0.533 ' HB2' ' N ' ' A' ' 119' ' ' ARG . 73.0 m -55.78 146.8 20.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.173 0.511 . . . . 0.0 111.369 175.306 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.73 -20.45 31.09 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.099 -179.586 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.3 -52.59 2.74 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.633 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 0.1 OUTLIER -94.56 -19.86 20.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.971 0.415 . . . . 0.0 111.08 -174.287 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.533 ' N ' ' HB2' ' A' ' 115' ' ' CYS . 4.9 mmt180 68.82 22.39 7.28 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.936 175.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ASN . . . . . 0.633 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 1.0 OUTLIER -63.9 130.23 43.26 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 171.725 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.665 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.6 OUTLIER -78.84 107.53 11.63 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.057 177.252 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.766 HD22 ' HA ' ' A' ' 128' ' ' PHE . 10.4 mt -63.99 139.73 58.8 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.441 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.477 ' O ' ' HB3' ' A' ' 405' ' ' ALA . 3.0 t -121.86 132.36 24.25 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.436 -170.498 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 123' ' ' VAL . 40.0 Cg_exo -55.42 110.72 0.59 Allowed 'Trans proline' 0 N--CA 1.461 -0.431 0 C-N-CA 122.59 2.193 . . . . 0.0 111.288 179.132 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 110.81 -16.29 28.4 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.583 -177.566 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.485 ' O ' ' HA ' ' A' ' 404' ' ' ILE . 3.3 t70 -116.61 -153.36 0.53 Allowed 'General case' 0 C--N 1.326 -0.423 0 O-C-N 122.665 -0.315 . . . . 0.0 110.641 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.64 139.54 43.65 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -171.221 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.766 ' HA ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -157.74 144.94 18.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.929 -1.032 . . . . 0.0 108.618 170.955 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 129' ' ' HIS . . . . . 0.59 ' CE1' ' HD2' ' A' ' 141' ' ' ARG . 2.3 m80 -137.35 120.57 16.81 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.425 178.427 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.427 ' HB2' ' CE2' ' A' ' 128' ' ' PHE . 11.0 t80 -115.68 101.14 8.57 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 175.008 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -126.71 126.57 68.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.553 -178.099 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.2 t30 58.5 25.72 13.4 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.166 -178.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 78.57 36.38 29.92 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.388 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' SER . . . . . 0.571 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 0.5 OUTLIER -139.55 150.48 45.12 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -179.014 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 43.5 mt -104.22 123.61 47.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.741 0.305 . . . . 0.0 111.489 -174.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.571 ' CE2' ' HB2' ' A' ' 134' ' ' SER . 39.5 m-85 -138.17 178.52 7.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.383 -0.826 . . . . 0.0 108.863 176.701 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 28.4 p -130.78 -153.18 0.55 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.008 0.432 . . . . 0.0 109.953 174.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.421 ' HA ' ' HD3' ' A' ' 141' ' ' ARG . 1.5 tt0 -77.7 -27.29 50.68 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.458 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -84.17 -53.21 5.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.072 -171.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.553 ' CG ' ' HB3' ' A' ' 118' ' ' CYS . 3.4 p-10 -96.07 31.17 2.21 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.692 0.758 . . . . 0.0 110.741 -178.463 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 141' ' ' ARG . . . . . 0.59 ' HD2' ' CE1' ' A' ' 129' ' ' HIS . 0.4 OUTLIER -62.29 126.3 87.54 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.855 179.828 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 142' ' ' PRO . . . . . 0.501 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 3.0 Cg_exo -73.93 124.94 9.52 Favored 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.993 2.462 . . . . 0.0 112.205 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.34 53.13 2.69 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.353 0.597 . . . . 0.0 110.905 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -150.43 -77.04 0.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.233 -179.559 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.69 91.25 7.91 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.769 177.619 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 12.5 tt . . . . . 0 C--N 1.322 -0.599 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.47 -178.663 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.619 0 CA-C-O 120.701 0.056 . . . . 0.0 113.14 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 208' ' ' SER . . . . . 0.629 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 4.9 m -107.46 129.6 54.93 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 171.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 404' ' ' ILE . . . . . 0.485 ' HA ' ' O ' ' A' ' 126' ' ' ASP . 50.8 mm -109.81 129.85 63.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.787 -172.625 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 405' ' ' ALA . . . . . 0.529 ' HB2' ' HB3' ' A' ' 128' ' ' PHE . . . -64.69 134.14 95.93 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.969 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 406' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 5.6 Cg_exo -73.88 -176.48 2.62 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 123.011 2.474 . . . . 0.0 112.053 179.333 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -107.09 155.54 39.07 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.867 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 408' ' ' PRO . . . . . 0.608 ' HB2' HD23 ' A' ' 99' ' ' LEU . 53.8 Cg_exo -53.12 134.66 57.06 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.813 2.342 . . . . 0.0 112.846 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.19 175.71 9.33 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.162 -178.155 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -91.23 134.15 34.8 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.051 178.162 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 411' ' ' ALA . . . . . 0.834 ' HB2' HG21 ' A' ' 100' ' ' VAL . . . -83.51 178.73 7.88 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.417 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.9 tp -72.45 120.57 81.27 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 174.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -55.11 121.41 9.86 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.663 2.242 . . . . 0.0 112.06 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.738 HG21 ' HB3' ' A' ' 93' ' ' SER . 0.2 OUTLIER -82.34 162.17 22.31 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.546 179.821 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 415' ' ' SER . . . . . 0.527 ' HA ' ' HA3' ' A' ' 82' ' ' GLY . 24.2 m . . . . . 0 CA--C 1.529 0.169 0 O-C-N 123.753 0.658 . . . . 0.0 110.058 -174.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.946 0 N-CA-C 112.088 -0.405 . . . . 0.0 112.088 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.66 -26.94 4.43 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.787 0.327 . . . . 0.0 111.342 -176.318 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -80.83 -14.18 58.28 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.026 0.441 . . . . 0.0 111.372 -174.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.45 104.96 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.39 0.614 . . . . 0.0 111.593 -175.594 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.782 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 9.3 ptt-85 -124.53 4.29 8.31 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.691 175.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.949 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -94.5 46.73 1.15 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.535 -171.527 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 51.0 35.35 12.52 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 121.498 0.666 . . . . 0.0 110.874 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 121.38 -129.2 7.64 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 -173.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.589 ' HA ' HD12 ' A' ' 80' ' ' LEU . 64.6 t30 -142.74 79.84 1.67 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.128 0.49 . . . . 0.0 111.462 175.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.29 -55.48 2.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.947 174.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 177.79 144.35 5.42 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.822 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.949 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -160.51 158.79 29.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.642 0.221 . . . . 0.0 110.836 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.833 ' HB2' ' HA ' ' A' ' 108' ' ' TYR . 0.1 OUTLIER -86.83 145.76 26.48 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.982 178.474 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.2 -12.54 60.91 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.088 -0.383 . . . . 0.0 111.714 -178.398 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.527 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -82.86 -47.87 11.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.586 0.231 . . . . 0.0 110.718 -177.495 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 2.6 p -126.84 -42.87 1.73 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.753 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.782 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 75.19 15.74 80.97 Favored Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.842 -0.617 . . . . 0.0 113.682 179.158 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.3 76.0 8.25 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 117.184 0.492 . . . . 0.0 111.687 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.499 ' HA ' HG21 ' A' ' 414' ' ' THR . 0.7 OUTLIER 62.43 128.67 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 O-C-N 124.228 0.955 . . . . 0.0 113.458 172.765 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.686 HD13 HG11 ' A' ' 100' ' ' VAL . 1.3 mt -103.82 99.51 16.46 Favored Pre-proline 0 C--N 1.32 -0.69 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 170.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.452 ' HD3' ' O ' ' A' ' 93' ' ' SER . 5.4 Cg_exo -78.54 159.17 28.84 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.175 2.583 . . . . 0.0 112.103 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.95 -16.89 56.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.372 0.606 . . . . 0.0 109.674 174.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.1 -35.25 31.9 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.965 -178.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -100.74 118.45 36.86 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.452 ' O ' HD23 ' A' ' 110' ' ' LEU . 1.9 mt -68.78 139.4 55.28 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.66 -179.023 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.686 HG11 HD13 ' A' ' 94' ' ' ILE . 2.7 m -117.74 148.75 20.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.284 0.564 . . . . 0.0 111.38 -176.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.7 115.85 27.38 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.994 -177.302 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 18.6 ptt180 -112.04 135.46 52.65 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.333 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -113.67 -122.59 0.29 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.201 -177.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.23 -54.13 48.04 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.071 0.462 . . . . 0.0 111.506 -176.606 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -162.1 31.83 0.32 Allowed Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -140.56 158.77 43.5 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -177.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -120.53 139.76 46.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.691 -176.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' TYR . . . . . 0.833 ' HA ' ' HB2' ' A' ' 87' ' ' CYS . 74.5 m-85 -137.46 160.34 39.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.36 178.106 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.787 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 29.0 m80 -85.84 152.2 23.19 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.452 HD23 ' O ' ' A' ' 99' ' ' LEU . 1.5 pp -65.86 -21.17 66.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.0 0.428 . . . . 0.0 111.045 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.428 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.86 -23.47 21.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.196 0.522 . . . . 0.0 110.335 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.787 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 12.4 m -94.2 -2.3 52.73 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.331 -178.362 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' PHE . . . . . 0.602 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.0 OUTLIER -76.62 74.75 3.31 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.229 0.538 . . . . 0.0 110.33 177.127 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.482 HG22 ' HA ' ' A' ' 121' ' ' ARG . 2.2 p -130.6 154.26 48.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.06 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.565 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 17.0 p -72.56 150.91 42.73 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.099 0.476 . . . . 0.0 110.273 177.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.05 2.0 52.92 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.478 -177.041 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.62 -50.78 3.34 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -176.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.64 -2.78 10.92 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.841 0.353 . . . . 0.0 110.93 -177.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 62.24 41.15 10.78 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.782 -179.383 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -89.44 128.78 35.99 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.482 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.0 OUTLIER -72.45 126.76 30.63 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.826 0.345 . . . . 0.0 110.316 -177.894 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.794 HD22 ' HB2' ' A' ' 128' ' ' PHE . 0.7 OUTLIER -80.86 132.88 35.5 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.564 179.625 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -127.24 139.28 34.7 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.789 -173.094 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.98 110.93 0.75 Allowed 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.213 1.942 . . . . 0.0 110.612 171.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 112.65 -5.83 26.16 Favored Glycine 0 N--CA 1.447 -0.586 0 N-CA-C 111.26 -0.736 . . . . 0.0 111.26 -174.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -117.52 165.7 13.24 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 176.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 2.0 mtm-85 -93.81 131.32 39.29 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.122 0.487 . . . . 0.0 111.348 -174.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.794 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -138.63 171.84 13.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.22 -179.386 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 129' ' ' HIS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 86.1 m-70 -131.94 133.77 44.9 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.786 0.327 . . . . 0.0 110.776 178.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.487 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 69.2 t80 -125.47 101.61 7.01 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 1.5 mt -129.83 128.92 65.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.432 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 63.93 18.28 11.09 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 123.515 0.509 . . . . 0.0 110.992 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.487 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 81.82 30.52 35.28 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.225 -176.458 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.484 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.9 OUTLIER -126.13 155.33 41.84 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 -176.894 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.608 ' HB3' HD11 ' A' ' 122' ' ' LEU . 12.2 mt -108.21 123.7 49.16 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.161 0.505 . . . . 0.0 111.286 -174.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.645 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 22.1 m-85 -129.71 174.9 9.27 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 174.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 10.4 p -127.62 -175.82 3.58 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.457 0.646 . . . . 0.0 111.589 -174.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.475 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -72.77 -25.52 61.2 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.279 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 47.4 t60 -76.9 -39.2 51.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.769 -175.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.486 ' OD1' ' HB3' ' A' ' 136' ' ' PHE . 1.7 p30 -85.28 -58.77 2.55 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.364 178.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.408 ' N ' ' OD1' ' A' ' 140' ' ' ASP . 0.4 OUTLIER 55.27 72.29 1.09 Allowed Pre-proline 0 C--N 1.327 -0.397 0 C-N-CA 123.146 0.579 . . . . 0.0 111.971 174.019 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.0 99.51 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.39 2.06 . . . . 0.0 111.866 176.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -92.56 -21.25 20.2 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.53 -171.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -68.32 -24.41 64.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.601 -178.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -141.25 60.23 1.51 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.062 0.458 . . . . 0.0 111.253 -178.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -126.82 102.12 8.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.592 0.711 . . . . 0.0 110.102 176.165 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -72.21 100.0 2.49 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.927 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 123.26 -4.84 9.53 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.599 -0.81 . . . . 0.0 111.944 -177.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.47 65.36 1.7 Allowed Glycine 0 C--N 1.332 0.307 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 176.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 203' ' ' SER . . . . . 0.404 ' HB2' ' H ' ' A' ' 204' ' ' GLY . 1.2 m -95.5 -101.98 0.16 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.542 -0.329 . . . . 0.0 110.397 179.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 204' ' ' GLY . . . . . 0.404 ' H ' ' HB2' ' A' ' 203' ' ' SER . . . -86.76 54.91 4.64 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.502 -178.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 82.79 102.57 0.48 Allowed Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.603 -178.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.61 133.37 51.02 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 177.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -112.56 56.94 0.45 Allowed Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.684 -175.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.23 130.33 36.37 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.855 0.359 . . . . 0.0 110.755 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 35.7 mm -120.15 137.47 53.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.912 -176.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 405' ' ' ALA . . . . . 0.499 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -61.82 133.57 93.77 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.479 -177.365 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 406' ' ' PRO . . . . . 0.602 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 15.2 Cg_exo -68.69 172.48 11.51 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.111 2.541 . . . . 0.0 112.401 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -97.1 158.1 33.87 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.144 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 408' ' ' PRO . . . . . 0.416 ' HB2' ' HB2' ' A' ' 99' ' ' LEU . 14.2 Cg_endo -88.91 128.63 1.97 Allowed 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.762 2.308 . . . . 0.0 112.976 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -130.73 163.03 28.16 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -77.29 127.98 33.54 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 122.088 -0.383 . . . . 0.0 110.371 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -105.75 -84.29 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.56 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.423 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.4 OUTLIER -131.53 144.27 52.69 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.046 -176.118 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 413' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 5.6 Cg_exo -79.38 147.04 19.98 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.886 2.391 . . . . 0.0 111.037 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.499 HG21 ' HA ' ' A' ' 93' ' ' SER . 0.2 OUTLIER -86.55 147.62 25.87 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.831 0.348 . . . . 0.0 111.2 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 12.5 m -74.83 136.68 41.57 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.68 177.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -123.78 103.51 34.13 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.629 -0.259 . . . . 0.0 110.576 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -71.02 106.65 1.93 Allowed 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 123.024 2.483 . . . . 0.0 112.38 -179.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.482 -0.771 . . . . 0.0 110.555 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.233 0 N-CA-C 112.159 -0.376 . . . . 0.0 112.159 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.21 89.51 2.53 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.937 0.399 . . . . 0.0 111.515 -177.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -143.22 26.75 1.63 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.204 0.526 . . . . 0.0 110.597 178.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 1.2 mt -83.68 76.84 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.298 0.57 . . . . 0.0 110.722 -176.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.538 ' HE ' ' HA2' ' A' ' 91' ' ' GLY . 19.9 ptt180 -132.72 19.21 4.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.613 176.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.495 HD22 ' HB2' ' A' ' 86' ' ' ALA . 0.9 OUTLIER -113.08 -174.72 2.51 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.89 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -77.73 -35.97 51.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.96 0.409 . . . . 0.0 110.921 -177.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -116.34 -129.53 4.41 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 177.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 18.6 p30 -147.01 22.56 1.22 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.211 0.529 . . . . 0.0 110.356 175.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.87 -58.78 3.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.115 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 93' ' ' SER . . . -170.16 146.78 10.16 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 111.519 -0.633 . . . . 0.0 111.519 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.495 ' HB2' HD22 ' A' ' 80' ' ' LEU . . . -129.06 141.83 51.09 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.771 0.319 . . . . 0.0 110.986 -177.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.736 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 41.9 t -62.38 145.84 52.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.137 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.41 -25.42 42.09 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.611 176.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -96.0 -47.95 5.89 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.139 -177.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 56.0 m -83.06 -62.66 1.54 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.254 0.55 . . . . 0.0 110.244 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.736 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 118.19 -19.39 10.92 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.426 -175.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -78.11 177.38 8.38 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.937 0.399 . . . . 0.0 110.922 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 0.5 OUTLIER -84.76 173.82 10.38 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.699 -174.69 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.463 HG12 HG11 ' A' ' 100' ' ' VAL . 2.3 mp -110.38 110.36 58.08 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.862 177.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.4 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 3.1 Cg_exo -78.22 161.49 29.09 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 123.106 2.538 . . . . 0.0 112.127 177.577 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.19 -16.65 57.68 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.209 0.528 . . . . 0.0 110.987 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -93.8 -21.41 19.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.163 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.4 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 1.0 OUTLIER -101.04 108.61 20.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.216 0.531 . . . . 0.0 110.064 -179.514 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 14.2 mt -66.96 131.53 46.06 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.249 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.699 ' HB ' ' O ' ' A' ' 108' ' ' TYR . 17.3 m -117.36 166.95 11.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.995 -175.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.9 111.96 20.39 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.436 ' H ' ' HG3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -110.7 139.84 45.61 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.627 -175.914 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -119.78 -165.11 1.13 Allowed 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.134 179.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.01 87.19 7.38 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.909 0.385 . . . . 0.0 110.543 -178.397 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 140.82 -48.03 0.84 Allowed Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.47 176.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -142.59 175.73 9.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.599 0.237 . . . . 0.0 110.383 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 5.0 p -132.6 141.01 46.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.881 -176.004 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' TYR . . . . . 0.699 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 1.4 m-85 -120.18 -173.87 2.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.193 175.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.773 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 74.7 m80 -103.91 -157.67 0.62 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 177.044 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.45 HD12 ' HB3' ' A' ' 408' ' ' PRO . 0.3 OUTLIER -86.53 -22.29 26.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.008 176.248 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.84 -36.02 15.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.611 -174.069 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.773 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.62 -17.72 59.02 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.531 -174.989 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.87 85.35 0.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.766 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.49 HG23 ' HD2' ' A' ' 121' ' ' ARG . 0.6 OUTLIER -143.09 158.44 43.6 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.653 -178.42 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.47 ' HB3' ' H ' ' A' ' 120' ' ' ASN . 42.2 t -62.1 149.76 40.35 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.878 0.37 . . . . 0.0 110.182 175.124 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 3.5 m -92.68 -14.09 28.54 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.092 0.472 . . . . 0.0 110.579 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.79 -49.6 4.31 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.032 -178.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.09 4.58 13.69 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -174.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 63.9 13.2 7.4 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.466 0.707 . . . . 0.0 112.708 175.062 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ASN . . . . . 0.47 ' H ' ' HB3' ' A' ' 115' ' ' CYS . 6.0 t-20 -63.66 123.86 19.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.816 -178.452 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.49 ' HD2' HG23 ' A' ' 114' ' ' THR . 0.7 OUTLIER -73.31 116.31 13.71 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.982 0.42 . . . . 0.0 110.894 179.282 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.596 HD22 ' HB2' ' A' ' 128' ' ' PHE . 0.7 OUTLIER -75.04 154.51 37.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.126 -179.506 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.496 HG23 ' CB ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -142.54 146.76 40.03 Favored Pre-proline 0 C--N 1.327 -0.402 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.868 -170.015 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -68.06 111.83 2.56 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.823 2.348 . . . . 0.0 111.768 175.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 113.85 -9.36 23.44 Favored Glycine 0 N--CA 1.448 -0.528 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 -177.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.496 ' CB ' HG23 ' A' ' 123' ' ' VAL . 6.4 t70 -105.42 -145.12 0.38 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 173.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.532 ' HD2' ' OE2' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -133.53 146.7 51.29 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.029 0.442 . . . . 0.0 110.992 179.127 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.596 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -143.1 145.4 32.82 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.458 178.148 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -109.39 126.39 53.38 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.108 0.48 . . . . 0.0 110.518 -178.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.449 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 4.6 t80 -124.2 101.5 7.23 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.509 HG21 ' HB3' ' A' ' 145' ' ' LEU . 0.5 OUTLIER -122.46 115.56 46.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.253 -178.709 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 12.1 t30 59.65 42.64 16.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.753 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.449 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 67.52 35.83 87.35 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.792 177.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 14.9 m -133.5 135.89 44.73 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 122.606 -0.35 . . . . 0.0 110.121 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 20.6 mt -89.48 120.94 31.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.93 -177.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 -130.11 167.84 17.71 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.442 177.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' CYS . . . . . 0.411 ' HB3' ' HB2' ' A' ' 115' ' ' CYS . 4.5 p -132.47 -169.44 2.23 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.076 0.465 . . . . 0.0 111.35 -177.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.532 ' OE2' ' HD2' ' A' ' 127' ' ' ARG . 5.1 mm-40 -72.69 -31.01 64.72 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.572 -173.308 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -66.24 -43.72 85.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.36 -173.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.466 ' OD2' ' HD3' ' A' ' 142' ' ' PRO . 14.9 p-10 -91.38 -49.85 6.12 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.733 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 41.73 69.56 2.04 Favored Pre-proline 0 N--CA 1.47 0.563 0 O-C-N 123.641 0.588 . . . . 0.0 111.543 178.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.466 ' HD3' ' OD2' ' A' ' 140' ' ' ASP . 32.0 Cg_endo -62.55 92.67 0.14 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.134 2.556 . . . . 0.0 112.756 -174.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.98 6.87 5.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.728 -175.273 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -87.03 -12.0 48.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.915 172.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.509 ' HB3' HG21 ' A' ' 131' ' ' ILE . 0.5 OUTLIER -110.62 -50.64 2.94 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.321 178.61 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.417 ' H ' HG13 ' A' ' 146' ' ' ILE . 0.0 OUTLIER -81.42 129.67 37.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.274 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.66 93.05 0.49 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -173.504 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 81.07 -63.59 4.28 Favored Glycine 0 CA--C 1.52 0.369 0 CA-C-N 115.936 -0.575 . . . . 0.0 114.238 168.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 99.19 84.02 1.76 Allowed Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 -172.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -79.94 65.45 5.11 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.921 0.391 . . . . 0.0 111.648 -174.166 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 78.63 -70.34 2.7 Favored Glycine 0 C--N 1.331 0.263 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -116.62 129.3 8.35 Favored Glycine 0 N--CA 1.443 -0.893 0 N-CA-C 110.576 -1.01 . . . . 0.0 110.576 175.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 25.8 m -146.32 160.19 42.36 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.936 0.368 . . . . 0.0 110.537 -177.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 105.7 -166.21 14.18 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.309 178.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.5 172.13 13.15 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -178.614 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 26.5 mm -84.42 -76.03 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 405' ' ' ALA . . . . . 0.4 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . 179.34 151.67 0.52 Allowed Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.616 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 406' ' ' PRO . . . . . 0.405 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 15.9 Cg_exo -68.92 -16.27 40.95 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.215 1.943 . . . . 0.0 110.649 172.314 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 407' ' ' PHE . . . . . 0.405 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 2.6 m-85 74.15 145.8 0.11 Allowed Pre-proline 0 C--N 1.34 0.158 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.214 177.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 408' ' ' PRO . . . . . 0.45 ' HB3' HD12 ' A' ' 110' ' ' LEU . 37.9 Cg_endo -67.23 115.32 3.6 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.306 2.004 . . . . 0.0 111.76 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -134.4 175.08 9.84 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.689 -177.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -100.32 135.58 41.54 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 411' ' ' ALA . . . . . 0.427 ' HB3' HG21 ' A' ' 94' ' ' ILE . . . -85.97 -102.99 0.06 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 175.094 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' A' ' 412' ' ' LEU . 17.2 mt -132.3 139.89 36.26 Favored Pre-proline 0 C--N 1.321 -0.655 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 174.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -53.75 133.46 54.32 Favored 'Trans proline' 0 C--O 1.236 0.388 0 C-N-CA 122.783 2.322 . . . . 0.0 112.218 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 5.7 m -58.33 141.39 51.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.518 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 415' ' ' SER . . . . . 0.434 ' O ' ' HD3' ' A' ' 417' ' ' PRO . 0.8 OUTLIER -72.83 76.26 1.14 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 171.944 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 76.9 t60 -82.94 109.56 17.68 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.265 -177.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 417' ' ' PRO . . . . . 0.434 ' HD3' ' O ' ' A' ' 415' ' ' SER . 99.0 Cg_endo -82.12 -28.29 2.04 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.561 2.174 . . . . 0.0 112.869 -177.235 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.853 -0.594 . . . . 0.0 111.337 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.654 0 N-CA-C 112.213 -0.355 . . . . 0.0 112.213 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.35 109.95 2.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.067 0.461 . . . . 0.0 111.869 -177.014 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -131.37 22.85 4.78 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.175 177.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.454 ' H ' HG13 ' A' ' 78' ' ' ILE . 0.1 OUTLIER -106.8 106.36 20.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.544 -177.542 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.641 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER -176.25 -26.57 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.637 177.136 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.569 HD11 ' H ' ' A' ' 84' ' ' SER . 0.4 OUTLIER -108.13 -178.97 3.76 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.035 -174.213 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -80.66 81.65 6.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.727 175.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 114.27 -134.56 11.83 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.774 -0.727 . . . . 0.0 111.315 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.432 ' HA ' HD21 ' A' ' 80' ' ' LEU . 53.1 p-10 -152.29 35.33 0.52 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.125 0.488 . . . . 0.0 110.822 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.569 ' H ' HD11 ' A' ' 80' ' ' LEU . 0.3 OUTLIER -106.62 -113.69 0.27 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.058 -179.613 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLY . . . . . 0.521 ' H ' ' HB2' ' A' ' 84' ' ' SER . . . -88.08 124.76 7.32 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.81 -176.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.447 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -140.16 160.53 39.75 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 177.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.87 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 42.2 t -78.55 145.17 34.98 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.432 0.634 . . . . 0.0 111.288 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.02 -11.51 50.19 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.935 177.231 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -107.58 -50.36 3.08 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.938 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 28.1 m -82.48 -54.36 5.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.449 0.643 . . . . 0.0 109.736 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.87 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 102.56 -10.37 56.13 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.153 -173.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.05 146.4 52.68 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 176.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.64 144.31 57.02 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.04 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.518 HG12 HG11 ' A' ' 100' ' ' VAL . 5.7 mt -93.72 118.6 67.44 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.237 178.723 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 94' ' ' ILE . 3.0 Cg_exo -77.21 144.56 23.51 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.998 2.465 . . . . 0.0 112.181 178.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.535 ' HB2' ' HB3' ' A' ' 413' ' ' PRO . . . -77.42 -6.34 53.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.2 0.524 . . . . 0.0 110.604 178.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.41 16.98 25.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.676 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -131.98 162.84 29.73 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.121 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' A' ' 409' ' ' GLU . 6.3 mt -106.69 116.06 31.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.167 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.518 HG11 HG12 ' A' ' 94' ' ' ILE . 4.5 m -119.37 150.82 21.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.156 -174.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.506 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -92.51 152.88 19.41 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.316 179.764 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.447 ' HB3' HG12 ' A' ' 107' ' ' VAL . 0.0 OUTLIER -153.9 159.78 41.89 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.855 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -122.4 -162.28 0.99 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.553 -178.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.72 12.08 2.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.163 -178.654 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -137.34 -81.3 0.1 OUTLIER Glycine 0 N--CA 1.442 -0.935 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.526 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -106.52 175.44 5.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.8 0.333 . . . . 0.0 111.754 -174.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.447 HG12 ' HB3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -108.31 149.83 11.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.126 -177.57 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 108' ' ' TYR . . . . . 0.492 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 32.2 m-85 -141.77 -168.72 2.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.254 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.76 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 74.6 m80 -110.58 -157.42 0.61 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 172.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -86.17 -23.17 26.63 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.907 0.384 . . . . 0.0 111.266 176.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.41 -36.99 15.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.791 -174.07 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.76 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -74.58 -13.06 60.61 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.234 -174.375 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -79.23 64.2 4.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.33 0.586 . . . . 0.0 109.996 175.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -125.17 154.88 40.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.483 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.425 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 12.5 t -62.91 135.93 57.57 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.258 0.552 . . . . 0.0 110.68 176.407 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 2.4 m -81.88 -17.5 47.06 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.697 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.32 -51.34 4.63 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -176.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 14.6 p -114.14 -7.09 13.05 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.379 -174.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.425 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 76.76 13.01 2.32 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.001 176.662 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -63.68 118.36 8.16 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 174.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.01 122.68 17.93 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 177.374 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.7 HD13 ' HD2' ' A' ' 128' ' ' PHE . 11.4 mt -68.08 127.22 32.08 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.339 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.5 ' HB ' ' CB ' ' A' ' 126' ' ' ASP . 71.0 t -107.61 134.12 20.14 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -172.525 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -55.82 109.95 0.49 Allowed 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 122.032 1.821 . . . . 0.0 111.018 175.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.37 6.5 56.58 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.507 -175.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.5 ' CB ' ' HB ' ' A' ' 123' ' ' VAL . 27.3 t0 -121.89 173.94 7.19 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 122.643 -0.328 . . . . 0.0 110.566 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.577 ' HB2' ' HG3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -65.34 140.82 58.7 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.22 0.533 . . . . 0.0 112.335 -176.569 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.7 ' HD2' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -156.64 170.26 22.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.404 -0.817 . . . . 0.0 108.844 177.516 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -146.16 137.48 24.66 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.692 0.282 . . . . 0.0 110.683 176.7 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -125.03 100.92 6.8 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.77 HG21 HG23 ' A' ' 146' ' ' ILE . 7.1 mm -120.13 104.35 15.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.147 -177.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.1 t30 56.54 55.83 6.13 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.545 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 63.9 33.08 86.28 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.36 -0.837 . . . . 0.0 113.243 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.438 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 1.2 m -131.84 132.83 44.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -178.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.524 ' HB3' HD11 ' A' ' 122' ' ' LEU . 38.2 mt -91.88 116.98 29.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.345 0.593 . . . . 0.0 111.107 -177.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.438 ' CE2' ' HB2' ' A' ' 134' ' ' SER . 61.4 m-85 -128.18 -179.47 5.02 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.238 -0.892 . . . . 0.0 108.712 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' CYS . . . . . 0.721 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 10.3 p -129.25 -178.91 4.85 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.036 0.446 . . . . 0.0 110.659 176.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.577 ' HG3' ' HB2' ' A' ' 127' ' ' ARG . 1.4 mm-40 -79.13 -14.19 59.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.387 179.073 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' HIS . . . . . 0.721 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 71.2 t60 -70.97 -47.22 60.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.26 0.552 . . . . 0.0 109.643 -178.458 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.52 29.73 5.9 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.571 175.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.567 ' HD2' ' H ' ' A' ' 206' ' ' SER . 14.5 ttp180 -22.64 99.22 0.06 OUTLIER Pre-proline 0 N--CA 1.474 0.725 0 C-N-CA 125.812 1.645 . . . . 0.0 113.9 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.413 ' HG3' ' CG ' ' A' ' 136' ' ' PHE . 46.4 Cg_endo -97.55 73.31 0.09 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.449 2.766 . . . . 0.0 112.989 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.41 169.98 8.43 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.142 -0.349 . . . . 0.0 111.247 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . 65.66 -84.21 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.484 0.714 . . . . 0.0 111.206 178.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -93.05 20.82 6.36 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 176.205 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.77 HG23 HG21 ' A' ' 131' ' ' ILE . 5.7 mt 53.49 39.81 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.738 -171.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -173.13 113.12 0.23 Allowed 'General case' 0 C--O 1.232 0.172 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.104 -178.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 76.4 77.76 0.74 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.779 -0.724 . . . . 0.0 113.027 178.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -63.3 121.94 25.68 Favored Glycine 0 N--CA 1.452 -0.295 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 174.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -40.1 -66.91 0.27 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.712 0.805 . . . . 0.0 111.948 -178.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . -119.4 -161.46 11.65 Favored Glycine 0 CA--C 1.504 -0.651 0 N-CA-C 110.065 -1.214 . . . . 0.0 110.065 172.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -67.07 87.48 0.14 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.446 -0.883 . . . . 0.0 111.324 175.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 206' ' ' SER . . . . . 0.567 ' H ' ' HD2' ' A' ' 141' ' ' ARG . 1.4 m -56.6 -39.42 73.55 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.904 0.383 . . . . 0.0 110.644 -174.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 82.85 110.06 0.48 Allowed Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.521 -0.763 . . . . 0.0 114.385 169.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 208' ' ' SER . . . . . 0.64 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 68.7 m -156.45 138.3 14.33 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 171.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 46.5 mm -118.89 137.08 54.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.539 0.209 . . . . 0.0 110.576 -174.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 405' ' ' ALA . . . . . 0.476 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -75.23 134.48 73.87 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.125 -178.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 406' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 14.7 Cg_exo -70.3 -178.67 2.67 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 123.482 2.788 . . . . 0.0 112.458 177.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -97.95 157.92 33.75 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.333 -177.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 408' ' ' PRO . . . . . 0.448 ' HB3' ' SD ' ' A' ' 101' ' ' MET . 97.1 Cg_endo -87.51 121.04 1.55 Allowed 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.719 2.279 . . . . 0.0 112.054 172.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 409' ' ' GLU . . . . . 0.409 ' HA ' HD22 ' A' ' 99' ' ' LEU . 0.0 OUTLIER -137.99 178.08 7.39 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.297 178.043 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -62.25 149.75 41.02 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.095 0.474 . . . . 0.0 111.458 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -136.32 -145.23 0.21 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.575 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 4.4 tp -73.01 128.18 88.3 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.733 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 413' ' ' PRO . . . . . 0.535 ' HB3' ' HB2' ' A' ' 96' ' ' ALA . 9.9 Cg_exo -72.17 168.96 22.67 Favored 'Trans proline' 0 CA--C 1.532 0.4 0 C-N-CA 123.095 2.53 . . . . 0.0 113.668 -175.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 90.8 m -92.49 133.08 36.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.594 178.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 69.4 m 59.98 -102.69 0.14 Allowed 'General case' 0 CA--C 1.533 0.294 0 O-C-N 123.329 0.393 . . . . 0.0 111.255 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -125.23 133.74 25.12 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -76.87 55.36 4.89 Favored 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 122.766 2.311 . . . . 0.0 112.734 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 418' ' ' LYS . . . . . 0.469 ' H ' ' HG3' ' A' ' 418' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.882 0 CA-C-O 118.834 -0.603 . . . . 0.0 110.311 176.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.577 0 N-CA-C 111.897 -0.481 . . . . 0.0 111.897 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.0 m -134.75 169.44 17.33 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 -177.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -110.82 142.12 43.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.826 0.346 . . . . 0.0 111.025 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 30.8 mm -75.91 136.33 25.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.553 176.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.804 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 39.1 ttp180 -131.58 -42.55 1.04 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.481 0.657 . . . . 0.0 110.784 -176.104 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.47 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -82.15 127.02 32.72 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.348 178.13 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -66.83 105.17 1.51 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.471 ' O ' ' HB2' ' A' ' 83' ' ' ASN . . . 94.93 -94.26 1.73 Allowed Glycine 0 N--CA 1.442 -0.964 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 -172.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 5.0 t-20 170.24 167.48 0.06 Allowed 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 177.051 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.7 m 71.03 -60.94 0.5 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 172.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLY . . . . . 0.401 ' O ' ' HA ' ' A' ' 93' ' ' SER . . . -79.69 71.86 2.64 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.37 -172.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.47 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -148.18 170.78 17.11 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 122.293 0.237 . . . . 0.0 110.381 179.305 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.81 145.78 30.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.999 0.428 . . . . 0.0 110.231 -179.082 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.37 -8.31 55.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.542 -172.568 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.711 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -88.65 -54.11 4.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.642 0.258 . . . . 0.0 111.453 -176.187 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 31.5 p -98.28 -39.84 8.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.063 0.459 . . . . 0.0 110.509 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.804 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 96.77 8.74 56.91 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-N 115.652 -0.703 . . . . 0.0 112.223 -178.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -89.24 155.62 19.28 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.781 0.324 . . . . 0.0 110.321 177.13 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.509 ' HB3' ' HB ' ' A' ' 414' ' ' THR . 13.9 m -71.39 160.27 33.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.472 -174.082 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 23.3 mt -101.14 111.23 63.2 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.219 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.73 148.0 22.31 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 123.021 2.481 . . . . 0.0 111.3 172.02 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.94 -11.78 61.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.037 0.446 . . . . 0.0 111.594 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.85 1.0 57.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.26 0.552 . . . . 0.0 110.797 179.053 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.07 175.38 5.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.912 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.648 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 32.0 mt -124.11 133.17 53.67 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.694 0.283 . . . . 0.0 110.337 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -115.96 142.29 29.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.364 0.602 . . . . 0.0 110.6 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 5.1 mmt -85.56 113.98 22.22 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.788 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -99.44 121.93 41.83 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.203 -178.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -104.71 -83.34 0.5 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.769 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -123.64 60.2 1.1 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.24 0.543 . . . . 0.0 110.279 -179.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.65 -17.37 45.12 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.105 -179.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -92.38 157.94 16.34 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 177.605 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -131.81 144.01 38.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.994 0.426 . . . . 0.0 111.745 -175.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' TYR . . . . . 0.409 ' HD1' ' HB2' ' A' ' 89' ' ' ALA . 92.9 m-85 -138.7 165.96 25.61 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 175.12 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.832 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 30.6 m80 -87.44 168.92 12.68 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.482 178.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' A' ' 110' ' ' LEU . 0.4 OUTLIER -62.58 -31.22 72.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.247 0.546 . . . . 0.0 110.983 177.906 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.459 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.48 -20.78 23.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.905 179.388 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.832 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 35.3 m -91.27 -4.13 56.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.624 -174.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' PHE . . . . . 0.557 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.1 OUTLIER -85.16 91.83 8.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.952 0.406 . . . . 0.0 110.553 178.025 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.595 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.7 OUTLIER -146.43 156.19 43.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.237 -177.288 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.549 ' HB2' ' HB3' ' A' ' 137' ' ' CYS . 0.0 OUTLIER -70.82 152.64 43.52 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 169.501 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 1.4 p -93.21 -22.01 19.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -174.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.2 -51.05 4.56 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -172.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.701 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -101.57 -8.69 21.65 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.522 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.4 OUTLIER 62.78 44.75 6.21 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.429 -179.772 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ASN . . . . . 0.492 ' H ' ' HB3' ' A' ' 115' ' ' CYS . 44.3 t30 -80.44 118.55 22.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.597 176.468 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.595 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.9 OUTLIER -69.58 108.04 3.66 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 177.719 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.441 ' H ' ' HG ' ' A' ' 122' ' ' LEU . 0.6 OUTLIER -70.8 129.06 38.11 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.688 -179.669 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.2 t -145.26 146.71 31.37 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.778 -173.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.79 111.69 0.76 Allowed 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.63 2.22 . . . . 0.0 111.635 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.22 -19.77 13.09 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.338 -0.705 . . . . 0.0 111.338 -176.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.423 ' CG ' ' H ' ' A' ' 127' ' ' ARG . 9.6 t70 -101.93 -152.82 0.44 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.233 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.423 ' H ' ' CG ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -121.56 155.19 35.55 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.765 0.317 . . . . 0.0 110.815 -174.2 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.546 ' CE2' ' HB2' ' A' ' 130' ' ' TYR . 0.2 OUTLIER -157.61 143.31 17.31 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.655 174.3 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 129' ' ' HIS . . . . . 0.466 ' HE2' ' CD ' ' A' ' 138' ' ' GLU . 51.7 m-70 -121.33 122.81 40.67 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.831 0.348 . . . . 0.0 110.078 178.288 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.546 ' HB2' ' CE2' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -119.82 101.77 8.11 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 178.813 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.646 HD11 HD12 ' A' ' 146' ' ' ILE . 1.5 mt -108.52 103.21 15.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.13 -178.027 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.1 t30 58.17 28.5 16.58 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.803 177.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.409 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 92.75 30.17 9.93 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.775 -179.45 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -125.9 126.63 44.72 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 176.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.427 HD22 ' CD1' ' A' ' 122' ' ' LEU . 14.6 mt -91.66 115.7 28.27 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -174.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -136.38 179.01 6.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.461 176.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' CYS . . . . . 0.652 ' SG ' ' HB2' ' A' ' 139' ' ' HIS . 1.1 p -137.84 179.19 6.57 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.719 0.295 . . . . 0.0 110.792 176.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.466 ' CD ' ' HE2' ' A' ' 129' ' ' HIS . 6.8 mm-40 -73.72 -16.07 61.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.284 -176.343 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' HIS . . . . . 0.652 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 0.2 OUTLIER -78.43 -11.07 59.93 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.698 0.285 . . . . 0.0 110.885 -176.644 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.701 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 10.4 p-10 -127.82 -47.37 1.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.225 177.434 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.408 ' HD3' HG21 ' A' ' 146' ' ' ILE . 0.0 OUTLIER 46.77 68.43 3.47 Favored Pre-proline 0 N--CA 1.47 0.569 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 172.89 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.44 ' HD3' ' OD2' ' A' ' 140' ' ' ASP . 66.1 Cg_endo -94.6 -172.99 0.29 Allowed 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 122.884 2.389 . . . . 0.0 112.837 178.607 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' THR . . . . . 0.421 ' C ' ' H ' ' A' ' 145' ' ' LEU . 5.8 m 75.26 121.83 0.04 OUTLIER 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.226 -176.525 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -75.5 39.95 0.17 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.148 0.499 . . . . 0.0 111.023 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.421 ' H ' ' C ' ' A' ' 143' ' ' THR . 1.9 mt -162.69 27.06 0.1 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.093 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.646 HD12 HD11 ' A' ' 131' ' ' ILE . 3.0 tt -78.88 -15.82 13.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.088 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 72.47 159.98 0.22 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.109 -0.951 . . . . 0.0 111.913 177.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.54 100.69 2.69 Favored Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.627 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -82.49 179.69 53.05 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.794 -0.717 . . . . 0.0 111.894 179.283 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -75.31 81.52 2.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.086 0.47 . . . . 0.0 110.947 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 66.61 -105.1 1.2 Allowed Glycine 0 N--CA 1.448 -0.518 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.293 179.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -118.35 28.88 6.65 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.927 -0.654 . . . . 0.0 111.771 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 2.5 m -137.58 65.77 1.48 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.193 0.52 . . . . 0.0 110.68 176.041 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -70.21 -42.13 67.47 Favored Glycine 0 N--CA 1.449 -0.465 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.897 176.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 40.6 m -155.52 136.16 13.42 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.941 0.4 . . . . 0.0 110.582 177.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 15.0 mm -93.85 136.16 26.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.232 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 405' ' ' ALA . . . . . 0.47 ' HA ' ' CD1' ' A' ' 128' ' ' PHE . . . -60.72 143.0 91.41 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.311 -178.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 406' ' ' PRO . . . . . 0.557 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 71.9 Cg_endo -74.68 -164.35 0.22 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.723 2.282 . . . . 0.0 112.541 179.234 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -117.07 146.07 37.17 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.086 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 408' ' ' PRO . . . . . 0.648 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 74.1 Cg_endo -77.1 125.52 7.98 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 122.551 2.167 . . . . 0.0 112.267 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -130.33 152.75 49.4 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.55 178.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -77.1 110.68 11.96 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.085 0.469 . . . . 0.0 110.376 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -93.85 -135.52 0.18 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.074 -178.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.497 ' H ' ' HG ' ' A' ' 412' ' ' LEU . 0.1 OUTLIER -81.22 129.26 67.52 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 179.508 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -78.83 164.98 24.97 Favored 'Trans proline' 0 C--O 1.237 0.47 0 C-N-CA 122.654 2.236 . . . . 0.0 112.586 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.509 ' HB ' ' HB3' ' A' ' 93' ' ' SER . 4.1 t -75.55 164.7 26.07 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.972 179.311 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.2 m -70.29 134.77 48.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.635 177.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 37.6 m80 -69.15 126.93 93.12 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-O 120.878 0.37 . . . . 0.0 110.064 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.53 173.4 4.46 Favored 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 123.063 2.509 . . . . 0.0 113.995 -174.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 418' ' ' LYS . . . . . 0.454 ' H ' ' HG3' ' A' ' 418' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.03 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.949 -175.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.614 0 N-CA-C 112.228 -0.349 . . . . 0.0 112.228 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.8 m 56.97 59.41 3.48 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 122.805 0.442 . . . . 0.0 111.68 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -134.41 120.92 20.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.18 177.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -128.19 129.28 69.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.621 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.08 18.42 6.58 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.163 175.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.707 HD21 ' HB ' ' A' ' 414' ' ' THR . 0.3 OUTLIER -162.58 158.23 23.11 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.096 -179.414 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -62.59 -63.77 1.12 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.082 178.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -96.85 9.46 65.99 Favored Glycine 0 C--O 1.229 -0.19 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.402 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.54 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 5.2 t-20 61.01 94.49 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.482 0.658 . . . . 0.0 111.958 -178.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.436 ' HB2' HG22 ' A' ' 414' ' ' THR . 0.7 OUTLIER -146.82 -146.15 0.19 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 177.498 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.54 108.78 2.67 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.457 -0.878 . . . . 0.0 111.97 176.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.655 ' HB2' HD12 ' A' ' 80' ' ' LEU . . . -110.52 150.57 28.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.815 0.341 . . . . 0.0 111.381 -176.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -73.39 128.57 35.87 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 175.286 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.59 -5.39 47.54 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.638 -172.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.489 ' CB ' ' HB3' ' A' ' 112' ' ' CYS . . . -84.64 -46.93 11.02 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 121.039 -0.264 . . . . 0.0 110.738 -177.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.544 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 31.2 p -110.18 -74.65 0.64 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.192 -178.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.544 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 134.81 7.07 2.14 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 111.476 -0.649 . . . . 0.0 111.476 -176.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -73.88 131.45 41.5 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.059 0.457 . . . . 0.0 110.436 178.137 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.494 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 1.4 m -69.03 121.18 16.13 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.839 175.242 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.6 mp -74.89 113.52 25.51 Favored Pre-proline 0 C--N 1.326 -0.427 0 O-C-N 123.62 0.575 . . . . 0.0 112.287 -172.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.494 ' HD3' ' O ' ' A' ' 93' ' ' SER . 5.6 Cg_exo -80.56 167.49 18.93 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 123.407 2.738 . . . . 0.0 110.879 167.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.68 -1.47 24.93 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.056 0.455 . . . . 0.0 111.063 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.62 -29.09 22.82 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.071 178.258 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -85.97 173.89 9.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.502 -178.19 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.485 ' HB2' HD22 ' A' ' 110' ' ' LEU . 25.5 mt -125.73 128.77 48.28 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.592 -178.389 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.08 147.74 30.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.99 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 1.9 mtt -105.14 155.55 18.91 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.44 177.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 93.0 mtm-85 -112.6 98.69 7.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.677 0.275 . . . . 0.0 110.331 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -79.95 -36.36 36.31 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.121 0.486 . . . . 0.0 110.42 178.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.484 ' HB2' ' H ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -152.63 -127.45 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.675 178.69 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.484 ' H ' ' HB2' ' A' ' 104' ' ' GLN . . . -78.08 -26.31 60.28 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.741 -0.742 . . . . 0.0 111.853 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -103.27 162.31 13.1 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.937 0.399 . . . . 0.0 110.297 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 2.4 m -103.39 160.56 4.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.423 -176.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -137.29 143.1 41.98 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.634 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 7.6 m80 -69.27 161.87 28.36 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.871 0.367 . . . . 0.0 111.581 -177.383 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.485 HD22 ' HB2' ' A' ' 99' ' ' LEU . 0.3 OUTLIER -67.34 -27.63 67.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.231 0.538 . . . . 0.0 109.99 173.226 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.6 -23.19 22.01 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.738 178.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.634 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 63.6 m -94.77 -18.71 21.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.379 -176.244 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' PHE . . . . . 0.465 ' HD1' ' HA ' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -67.5 82.75 0.16 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.578 0.704 . . . . 0.0 110.508 177.029 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.604 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.5 p -135.47 160.99 36.73 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.693 -178.015 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.436 ' SG ' ' N ' ' A' ' 119' ' ' ARG . 26.2 p -72.73 149.94 43.3 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.349 0.595 . . . . 0.0 111.078 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.77 -2.27 58.51 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.455 179.232 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.575 ' HB ' ' SG ' ' A' ' 118' ' ' CYS . 0.8 OUTLIER -90.41 -54.68 3.9 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.65 -177.884 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.682 ' SG ' ' HB2' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -123.75 -20.9 5.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.231 -172.481 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.439 ' HB2' ' O ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER 81.02 50.97 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 123.812 0.845 . . . . 0.0 111.288 -179.289 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -97.32 151.65 19.69 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 169.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.604 ' HA ' HG22 ' A' ' 114' ' ' THR . 1.1 ttm180 -86.15 130.14 34.62 Favored 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.005 -176.297 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.419 HD13 ' HB2' ' A' ' 128' ' ' PHE . 16.0 mt -77.25 158.42 30.27 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 173.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -134.39 139.12 31.83 Favored Pre-proline 0 C--N 1.325 -0.476 0 C-N-CA 119.967 -0.693 . . . . 0.0 111.35 -169.046 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.437 ' HB3' ' HD3' ' A' ' 408' ' ' PRO . 11.7 Cg_endo -55.68 121.63 10.3 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 123.075 2.516 . . . . 0.0 111.874 177.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 91.0 -2.06 78.81 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.438 -0.887 . . . . 0.0 112.331 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -112.26 -179.2 3.61 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 177.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.511 ' HG2' HD13 ' A' ' 404' ' ' ILE . 1.3 mtt85 -88.78 149.14 23.57 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.417 0.627 . . . . 0.0 112.314 -171.289 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.419 ' HB2' HD13 ' A' ' 122' ' ' LEU . 0.6 OUTLIER -148.91 145.58 27.48 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 175.721 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 129' ' ' HIS . . . . . 0.57 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 60.8 m-70 -115.31 121.65 43.52 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.76 0.314 . . . . 0.0 110.915 -175.097 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.501 ' HA ' ' O ' ' A' ' 134' ' ' SER . 1.4 t80 -112.58 100.78 8.99 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 174.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.489 ' HB ' ' CE2' ' A' ' 136' ' ' PHE . 8.4 mt -124.04 124.01 67.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.198 -175.802 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 61.1 33.96 19.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.237 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 69.39 35.1 75.4 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.869 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.501 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.8 OUTLIER -131.67 154.24 49.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.798 0.299 . . . . 0.0 110.359 -178.046 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 13.2 mt -96.54 114.59 26.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.497 -177.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.57 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 30.9 m-85 -120.43 157.26 29.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.343 0.592 . . . . 0.0 110.414 179.068 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' CYS . . . . . 0.562 ' HB2' ' H ' ' A' ' 140' ' ' ASP . 0.5 OUTLIER -92.55 152.41 19.64 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.921 -175.233 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.428 ' OE1' ' HD2' ' A' ' 127' ' ' ARG . 16.8 tp10 -80.37 -24.83 39.5 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.731 0.776 . . . . 0.0 108.909 161.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -81.54 -52.55 7.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.931 -171.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.682 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -114.94 34.39 4.86 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -178.322 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.481 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 9.9 ttp-105 -48.4 129.38 13.23 Favored Pre-proline 0 N--CA 1.464 0.27 0 CA-C-N 114.323 -1.308 . . . . 0.0 112.511 -173.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 21.2 Cg_exo -66.03 141.4 63.92 Favored 'Trans proline' 0 C--O 1.235 0.358 0 C-N-CA 122.829 2.353 . . . . 0.0 112.086 178.238 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.11 -3.9 57.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.558 -179.204 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -97.55 -74.14 0.58 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.808 -176.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.496 ' H ' ' HG ' ' A' ' 145' ' ' LEU . 0.0 OUTLIER -84.12 85.77 7.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.922 0.392 . . . . 0.0 111.08 -176.159 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -143.12 138.39 26.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.991 176.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -87.55 45.77 1.31 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.193 0.52 . . . . 0.0 110.558 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 106.13 147.07 14.51 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.285 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -118.67 41.13 2.09 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.679 -0.772 . . . . 0.0 111.815 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.43 31.37 0.74 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.084 0.468 . . . . 0.0 111.366 -178.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 80.34 -74.67 2.31 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.657 178.173 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -83.07 37.89 2.71 Favored Glycine 0 N--CA 1.453 -0.192 0 C-N-CA 121.218 -0.515 . . . . 0.0 113.446 -174.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.35 -20.29 21.23 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.978 0.418 . . . . 0.0 110.192 176.374 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -105.04 171.85 19.26 Favored Glycine 0 N--CA 1.446 -0.684 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.183 178.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.43 -176.15 2.91 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.137 0.494 . . . . 0.0 111.316 -176.185 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 404' ' ' ILE . . . . . 0.511 HD13 ' HG2' ' A' ' 127' ' ' ARG . 10.7 mm -111.38 135.54 50.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 176.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -59.5 113.21 6.53 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 177.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 406' ' ' PRO . . . . . 0.466 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 83.7 Cg_exo -45.64 -72.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.655 2.904 . . . . 0.0 112.819 -172.288 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 407' ' ' PHE . . . . . 0.466 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 1.1 t80 168.95 139.28 0.05 OUTLIER Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.147 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 408' ' ' PRO . . . . . 0.437 ' HD3' ' HB3' ' A' ' 124' ' ' PRO . 73.1 Cg_endo -85.87 107.13 0.9 Allowed 'Trans proline' 0 N--CA 1.446 -1.323 0 C-N-CA 122.22 1.947 . . . . 0.0 110.907 171.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -129.81 168.98 15.74 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.428 -175.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -77.22 111.12 12.51 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.203 177.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -89.2 -168.63 2.23 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.966 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.428 ' H ' ' HG ' ' A' ' 412' ' ' LEU . 0.1 OUTLIER -64.68 121.17 71.71 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.27 179.408 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -57.26 127.48 25.77 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.773 2.315 . . . . 0.0 111.815 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.707 ' HB ' HD21 ' A' ' 80' ' ' LEU . 34.0 p -85.3 161.13 19.65 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.567 -175.833 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.1 m 64.92 -149.06 0.26 Allowed 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.038 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -127.56 92.78 42.17 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -69.87 135.65 30.73 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.834 2.356 . . . . 0.0 112.356 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.26 -0.876 . . . . 0.0 109.757 178.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.481 0 N-CA-C 111.839 -0.504 . . . . 0.0 111.839 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.69 -173.99 3.59 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 62.54 44.97 6.55 Favored 'General case' 0 N--CA 1.463 0.205 0 O-C-N 123.517 0.511 . . . . 0.0 110.815 177.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.479 ' H ' HG13 ' A' ' 78' ' ' ILE . 0.0 OUTLIER -100.27 93.87 3.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.25 178.846 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 48.1 ttt85 -75.3 -22.17 57.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.939 -174.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.685 ' HB3' ' HA ' ' A' ' 83' ' ' ASN . 6.5 mp -83.97 10.76 9.07 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.586 -175.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.406 ' C ' ' H ' ' A' ' 83' ' ' ASN . 0.3 OUTLIER 49.28 84.48 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.558 0 O-C-N 123.803 0.69 . . . . 0.0 111.805 177.039 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.08 -16.98 19.35 Favored Glycine 0 C--O 1.228 -0.253 0 C-N-CA 120.306 -0.95 . . . . 0.0 111.083 -174.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.685 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 1.8 t30 71.11 54.39 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 123.654 0.781 . . . . 0.0 111.3 175.146 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.68 -58.44 1.88 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.565 177.215 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -155.38 142.82 9.23 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.615 -0.803 . . . . 0.0 112.382 -178.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.519 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . . . -154.24 171.11 19.74 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.517 ' HB2' ' HA ' ' A' ' 108' ' ' TYR . 0.1 OUTLIER -95.76 145.04 25.63 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.1 m -82.01 6.37 16.35 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -174.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.642 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -96.98 -59.59 1.76 Allowed 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.86 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.446 ' SG ' ' HB2' ' A' ' 92' ' ' GLN . 19.8 p -92.72 -36.76 12.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.85 0.357 . . . . 0.0 110.108 178.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 98.04 -3.37 60.29 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.487 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.446 ' HB2' ' SG ' ' A' ' 90' ' ' CYS . 0.0 OUTLIER -81.18 159.14 24.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.937 0.398 . . . . 0.0 110.612 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.24 164.82 17.45 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.651 -173.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.5 mt -113.83 99.83 50.97 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.807 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -77.04 159.68 33.79 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.589 2.193 . . . . 0.0 111.243 174.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -70.07 -10.07 57.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.132 0.491 . . . . 0.0 111.125 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.51 -13.32 52.21 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.002 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -117.25 147.78 42.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.977 -178.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.633 ' HB2' ' HB2' ' A' ' 408' ' ' PRO . 1.0 OUTLIER -108.43 141.6 40.05 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.857 -179.657 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -115.59 139.66 40.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.139 0.495 . . . . 0.0 111.125 -177.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.19 122.1 28.89 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.659 177.312 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.482 HH21 ' CD ' ' A' ' 409' ' ' GLU . 0.0 OUTLIER -113.75 142.16 46.39 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.219 -178.649 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -118.48 -76.54 0.57 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.531 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.508 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 0.2 OUTLIER -90.64 -93.64 0.13 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.145 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.508 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -120.16 0.16 13.01 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.4 175.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -103.07 163.67 12.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.746 0.307 . . . . 0.0 110.821 -177.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.2 m -134.91 148.12 29.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.329 -178.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' TYR . . . . . 0.517 ' HA ' ' HB2' ' A' ' 87' ' ' CYS . 6.1 m-85 -138.67 146.59 41.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.68 177.08 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.933 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 54.2 m80 -72.33 168.74 17.73 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.442 HD21 ' HG3' ' A' ' 408' ' ' PRO . 0.3 OUTLIER -63.02 -31.85 73.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.207 0.527 . . . . 0.0 110.939 178.887 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.475 ' HG3' ' SG ' ' A' ' 112' ' ' CYS . 3.4 pttp -89.35 0.65 56.66 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.05 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.933 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 4.6 m -117.41 -10.1 10.76 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.557 -176.276 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.6 69.68 2.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.549 0.69 . . . . 0.0 110.251 176.517 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.749 HG22 ' HA ' ' A' ' 121' ' ' ARG . 19.7 p -138.71 153.45 48.51 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.152 -0.931 . . . . 0.0 109.425 -178.284 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.488 ' HB3' ' HA ' ' A' ' 136' ' ' PHE . 3.6 p -71.89 153.2 42.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.059 0.457 . . . . 0.0 110.673 179.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -84.15 -8.02 59.2 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.063 0.459 . . . . 0.0 110.727 178.036 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.16 -51.11 5.76 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.925 -178.229 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.61 -6.45 10.19 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.487 -177.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.453 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 61.78 35.86 16.51 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.063 0.459 . . . . 0.0 110.551 -179.272 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -80.95 131.61 35.34 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.643 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.749 ' HA ' HG22 ' A' ' 114' ' ' THR . 1.1 tpp85 -72.65 115.42 11.9 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.97 -178.178 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.475 HD13 ' HD2' ' A' ' 128' ' ' PHE . 5.6 mt -74.97 139.62 43.09 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 177.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -131.28 133.23 24.29 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-O 120.704 0.287 . . . . 0.0 111.603 -169.442 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -60.9 113.23 1.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.481 2.12 . . . . 0.0 110.538 171.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 120.21 -22.59 8.4 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 110.748 -0.941 . . . . 0.0 110.748 -173.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.01 -175.46 2.69 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.445 ' HB3' ' HG2' ' A' ' 138' ' ' GLU . 8.7 ttm-85 -99.07 148.37 24.11 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.849 0.357 . . . . 0.0 111.159 -173.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.475 ' HD2' HD13 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -143.2 156.76 44.83 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.508 176.366 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 129' ' ' HIS . . . . . 0.6 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 4.6 m-70 -117.39 117.89 30.72 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.001 0.429 . . . . 0.0 110.517 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.457 ' HA ' ' O ' ' A' ' 134' ' ' SER . 16.3 t80 -118.75 101.67 8.26 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 176.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -124.62 113.75 37.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.574 -177.598 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 7.0 t30 56.67 41.07 28.87 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.226 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 75.04 33.48 54.65 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.748 -0.739 . . . . 0.0 113.019 177.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.457 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.6 OUTLIER -126.98 145.45 50.7 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.828 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 79.1 mt -101.35 124.46 47.07 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.339 0.399 . . . . 0.0 110.967 -176.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.6 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 76.4 m-85 -135.95 164.4 28.06 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.613 175.269 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' CYS . . . . . 0.578 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 30.9 p -113.55 -167.23 1.17 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.28 0.562 . . . . 0.0 111.844 -175.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.445 ' HG2' ' HB3' ' A' ' 127' ' ' ARG . 1.3 mt-10 -75.36 -30.08 60.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.261 176.147 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' HIS . . . . . 0.481 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 77.6 t60 -73.84 -30.87 62.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.113 177.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.578 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.9 OUTLIER -66.47 -80.89 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.095 175.182 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.598 HH21 ' HA2' ' A' ' 205' ' ' GLY . 0.0 OUTLIER 48.97 59.65 16.78 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.362 -177.919 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.551 ' HD3' ' HB3' ' A' ' 140' ' ' ASP . 37.6 Cg_endo -66.01 92.37 0.26 Allowed 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.849 2.366 . . . . 0.0 112.03 -175.586 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' THR . . . . . 0.442 ' HA ' HG12 ' A' ' 146' ' ' ILE . 0.2 OUTLIER -76.23 58.86 1.31 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.371 -178.529 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -125.68 -65.88 0.97 Allowed 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.469 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -115.73 43.06 2.17 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.076 0.465 . . . . 0.0 110.266 179.059 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.442 HG12 ' HA ' ' A' ' 143' ' ' THR . 0.1 OUTLIER -74.52 152.98 6.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.833 -179.799 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -81.02 77.25 7.94 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.022 0.439 . . . . 0.0 111.056 -177.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 96.14 -61.6 1.31 Allowed Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.814 176.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 87.41 -102.3 2.77 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.36 -177.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 1.1 m 58.62 39.6 24.45 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.63 0.372 . . . . 0.0 111.795 174.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 118.54 -116.28 3.35 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.725 178.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 205' ' ' GLY . . . . . 0.598 ' HA2' HH21 ' A' ' 141' ' ' ARG . . . -90.92 67.68 2.37 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.767 -177.321 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.01 142.27 54.23 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.757 0.313 . . . . 0.0 111.048 177.35 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 121.65 127.44 3.38 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 121.002 -0.618 . . . . 0.0 111.634 -177.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.62 167.42 11.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.92 0.39 . . . . 0.0 110.686 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 46.9 mm -76.19 130.14 36.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -56.67 130.77 77.71 Favored Pre-proline 0 C--N 1.33 -0.247 0 O-C-N 123.337 0.398 . . . . 0.0 111.346 -177.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 406' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.78 162.07 30.01 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.851 2.368 . . . . 0.0 112.169 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -88.45 152.69 50.05 Favored Pre-proline 0 C--N 1.319 -0.758 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.043 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 408' ' ' PRO . . . . . 0.633 ' HB2' ' HB2' ' A' ' 99' ' ' LEU . 51.2 Cg_endo -70.27 126.62 13.17 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 122.161 1.907 . . . . 0.0 111.758 176.268 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 409' ' ' GLU . . . . . 0.482 ' CD ' HH21 ' A' ' 102' ' ' ARG . 2.6 mt-10 -127.0 160.7 30.32 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.465 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -79.5 123.52 27.64 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.651 -0.499 . . . . 0.0 109.651 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -103.38 -106.3 0.28 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.22 -177.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.78 117.23 37.8 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.42 131.94 26.07 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.578 2.186 . . . . 0.0 112.773 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 19.2 m -56.36 142.0 39.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.045 -0.98 . . . . 0.0 111.084 174.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 11.1 m -98.38 155.23 17.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.107 -176.016 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 416' ' ' HIS . . . . . 0.449 ' HA ' ' HD3' ' A' ' 417' ' ' PRO . 59.7 m80 -70.36 142.89 89.98 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.165 -0.47 . . . . 0.0 109.929 176.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 417' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 416' ' ' HIS . 3.5 Cg_exo -74.3 72.88 4.04 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 123.259 2.639 . . . . 0.0 112.644 -176.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.383 -0.818 . . . . 0.0 110.103 177.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.662 0 N-CA-C 111.475 -0.65 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -58.01 3.29 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.751 0.31 . . . . 0.0 111.427 -178.052 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -141.38 171.96 13.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.864 0.364 . . . . 0.0 111.047 -177.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 5.0 mt -87.61 107.5 17.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.32 -177.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.8 mtp85 -131.38 8.95 4.69 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.954 175.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.612 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 1.4 pt? -121.01 -179.43 4.02 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.494 -169.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -105.81 141.81 36.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.224 175.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.64 -40.95 2.99 Favored Glycine 0 CA--C 1.517 0.2 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.616 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.598 ' HA ' HD21 ' A' ' 80' ' ' LEU . 2.3 t-20 81.75 33.76 0.1 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.637 0.775 . . . . 0.0 112.198 175.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.449 ' N ' HD11 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -130.25 66.99 1.48 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.282 177.032 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 117.65 98.18 1.95 Allowed Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.459 -0.877 . . . . 0.0 113.093 175.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.612 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -138.33 156.47 47.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.144 0.497 . . . . 0.0 110.838 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 4.6 t -70.4 146.57 50.31 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.392 178.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.94 8.54 39.36 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.525 172.346 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.453 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -120.94 -59.62 1.72 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.453 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.487 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 30.3 p -93.09 -77.61 0.44 Allowed 'General case' 0 C--O 1.233 0.207 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.541 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.487 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 145.84 -3.03 1.08 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.642 -0.789 . . . . 0.0 113.142 176.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.9 tp60 -63.89 128.39 35.59 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 117.275 0.538 . . . . 0.0 110.616 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.857 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.7 OUTLIER -56.34 120.79 8.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.804 -0.634 . . . . 0.0 109.54 172.389 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.401 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 5.1 mt -75.89 113.39 26.83 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 112.224 0.454 . . . . 0.0 112.224 -172.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.677 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 5.7 Cg_exo -78.19 167.68 22.9 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.373 2.715 . . . . 0.0 111.083 172.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.19 -2.87 26.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.86 0.362 . . . . 0.0 111.16 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.93 8.38 34.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.954 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.677 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 1.6 mm-40 -119.03 134.54 55.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.885 177.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.543 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 1.4 mt -100.82 136.63 40.37 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.061 0.458 . . . . 0.0 110.342 -178.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 1.6 m -115.37 136.5 51.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.718 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.461 ' SD ' ' HG3' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -84.26 123.42 30.12 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.068 -179.446 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 13.2 ptt85 -90.24 121.46 32.28 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.103 -177.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -105.13 -27.35 11.65 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.922 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -179.41 -128.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.811 -178.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -78.33 -8.29 87.57 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.567 -0.825 . . . . 0.0 111.252 173.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 28.5 m-20 -102.93 142.05 34.7 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 177.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -126.49 141.54 45.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.005 0.431 . . . . 0.0 110.896 -177.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -129.29 172.77 11.15 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 177.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.795 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 13.9 m80 -85.17 170.73 12.59 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 177.069 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.416 ' HA ' ' SD ' ' A' ' 101' ' ' MET . 0.3 OUTLIER -69.63 -23.54 63.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.32 0.581 . . . . 0.0 109.521 173.578 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.485 ' HG2' ' HB3' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -90.25 -18.75 25.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.409 176.469 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.795 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 55.6 m -100.78 7.39 43.81 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.241 0.543 . . . . 0.0 111.06 -176.004 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' PHE . . . . . 0.453 ' HD1' ' HA ' ' A' ' 113' ' ' PHE . 0.1 OUTLIER -89.69 73.06 7.68 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.3 0.571 . . . . 0.0 110.273 177.84 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.628 HG22 ' HA ' ' A' ' 121' ' ' ARG . 15.2 p -133.48 155.7 49.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.145 -179.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 26.8 p -73.21 153.49 40.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.048 0.451 . . . . 0.0 110.816 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.49 2.16 42.3 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.977 -176.016 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -109.05 -51.63 2.86 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -179.005 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.95 -10.5 13.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.899 0.381 . . . . 0.0 110.941 -177.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 58.84 35.53 24.28 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.201 -177.006 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -73.87 120.8 19.96 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 174.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.628 ' HA ' HG22 ' A' ' 114' ' ' THR . 3.6 ttm180 -66.83 124.91 24.25 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.986 0.422 . . . . 0.0 110.749 -178.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.744 HD22 ' HB2' ' A' ' 128' ' ' PHE . 1.7 mt -76.75 158.91 30.58 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.138 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.547 ' O ' ' HB3' ' A' ' 405' ' ' ALA . 71.9 t -126.51 132.12 24.19 Favored Pre-proline 0 C--N 1.327 -0.41 0 C-N-CA 121.096 -0.241 . . . . 0.0 110.415 -172.423 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.06 111.39 0.89 Allowed 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.705 2.27 . . . . 0.0 111.096 175.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 93.49 17.09 43.53 Favored Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 120.568 -0.825 . . . . 0.0 111.793 -177.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -133.8 -176.17 4.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.815 0.34 . . . . 0.0 111.031 176.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -75.35 127.12 32.43 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.439 -172.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.744 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -145.62 165.72 27.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 172.593 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 129' ' ' HIS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 136' ' ' PHE . 0.6 OUTLIER -131.19 128.67 40.46 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.719 -0.613 . . . . 0.0 111.822 -178.194 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.462 ' HB2' ' CZ ' ' A' ' 128' ' ' PHE . 1.7 t80 -125.58 101.07 6.73 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.063 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 56.2 mt -110.22 103.81 16.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.192 -177.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.7 t30 53.64 38.91 29.38 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.686 0.617 . . . . 0.0 111.262 -178.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.406 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 85.63 21.46 53.64 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.65 -0.786 . . . . 0.0 113.297 177.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -113.76 134.06 54.99 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 117.201 0.501 . . . . 0.0 109.769 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.416 ' HA ' HD23 ' A' ' 135' ' ' LEU . 14.5 mt -88.64 115.25 26.03 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.937 0.399 . . . . 0.0 111.23 -176.317 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.55 ' HB2' ' HB3' ' A' ' 129' ' ' HIS . 63.9 m-85 -131.09 168.18 17.85 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.554 176.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' CYS . . . . . 0.654 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 24.9 p -113.78 -169.65 1.55 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.204 0.525 . . . . 0.0 110.854 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.65 -28.97 51.43 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.99 177.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -77.83 -28.28 50.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.493 0.663 . . . . 0.0 109.517 178.536 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.654 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.4 OUTLIER -67.18 -82.15 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.313 174.657 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 42.46 73.33 0.94 Allowed Pre-proline 0 C--O 1.237 0.438 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.964 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.554 ' O ' ' HB ' ' A' ' 146' ' ' ILE . 50.4 Cg_exo -55.41 100.91 0.08 OUTLIER 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.758 2.305 . . . . 0.0 111.711 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.61 56.49 3.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.825 -173.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -158.72 -78.1 0.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.558 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.505 ' HA ' HD22 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -89.01 71.73 8.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.436 0.636 . . . . 0.0 109.562 175.576 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.571 HG12 ' H ' ' A' ' 201' ' ' GLY . 11.5 tt -122.94 159.99 26.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.234 -176.178 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -80.46 -17.46 51.62 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.883 0.373 . . . . 0.0 110.48 177.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 201' ' ' GLY . . . . . 0.571 ' H ' HG12 ' A' ' 146' ' ' ILE . . . 168.02 126.35 0.84 Allowed Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.704 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 202' ' ' GLY . . . . . 0.417 ' O ' ' HB3' ' A' ' 206' ' ' SER . . . -91.0 -28.49 15.25 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.538 -0.839 . . . . 0.0 111.85 177.326 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.46 -52.61 2.03 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.97 0.414 . . . . 0.0 110.296 177.423 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . -79.15 105.0 2.18 Favored Glycine 0 N--CA 1.45 -0.39 0 N-CA-C 110.352 -1.099 . . . . 0.0 110.352 171.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 72.71 51.64 11.21 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 -170.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 206' ' ' SER . . . . . 0.417 ' HB3' ' O ' ' A' ' 202' ' ' GLY . 0.0 OUTLIER -64.34 -5.53 5.33 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -172.853 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 170.81 173.77 38.21 Favored Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 121.018 -0.611 . . . . 0.0 112.183 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -113.61 134.19 54.86 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.917 0.389 . . . . 0.0 110.2 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 38.5 mm -79.27 117.99 25.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 176.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 405' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 123' ' ' VAL . . . -59.94 132.79 89.61 Favored Pre-proline 0 C--O 1.235 0.34 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.321 -175.059 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 406' ' ' PRO . . . . . 0.521 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 2.8 Cg_exo -76.65 -170.81 0.96 Allowed 'Trans proline' 0 N--CA 1.462 -0.364 0 C-N-CA 123.663 2.909 . . . . 0.0 112.414 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -104.73 158.36 32.16 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.269 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 408' ' ' PRO . . . . . 0.543 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 5.8 Cg_exo -77.62 141.4 19.65 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.778 2.318 . . . . 0.0 112.086 178.13 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.32 177.28 7.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.291 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -104.28 121.1 42.63 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 178.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -84.8 -102.94 0.05 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.219 -178.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -131.74 130.89 22.44 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -68.01 145.33 67.27 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.132 1.888 . . . . 0.0 111.658 176.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.857 HG21 ' HB3' ' A' ' 93' ' ' SER . 0.1 OUTLIER -76.19 178.1 6.68 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.055 -176.196 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.48 166.58 23.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.099 178.06 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 48.7 m-70 -95.67 120.29 63.65 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.825 -176.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -86.83 5.81 5.64 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.719 2.279 . . . . 0.0 111.866 176.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 2.2 tpmp? . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.168 -0.92 . . . . 0.0 110.555 -179.954 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.837 0 N-CA-C 111.76 -0.536 . . . . 0.0 111.76 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.1 76.82 1.62 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.192 0.52 . . . . 0.0 111.236 -177.356 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -122.18 118.29 28.27 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 176.479 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -108.56 143.33 19.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.07 0.462 . . . . 0.0 110.905 -175.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.637 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER -85.77 74.66 10.18 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.807 177.147 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.717 HD21 ' HB ' ' A' ' 414' ' ' THR . 0.5 OUTLIER -144.76 -179.97 6.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.948 0.404 . . . . 0.0 111.281 -177.847 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -92.15 -60.56 1.82 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.219 177.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.536 ' HA3' ' HA ' ' A' ' 415' ' ' SER . . . -87.19 -1.89 83.82 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.185 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 60.92 93.42 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.342 0.591 . . . . 0.0 111.923 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.47 ' HB2' HG22 ' A' ' 414' ' ' THR . 0.6 OUTLIER -146.31 -76.78 0.19 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.475 178.733 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -148.1 127.05 2.48 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 110.519 -1.033 . . . . 0.0 110.519 177.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -118.69 164.47 15.31 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.851 0.358 . . . . 0.0 111.296 -175.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 27.9 t -63.79 144.3 57.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.237 177.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.54 -8.16 58.47 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.297 -178.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.431 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -111.37 -33.69 6.34 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.08 -0.248 . . . . 0.0 111.148 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.486 ' SG ' ' NZ ' ' A' ' 111' ' ' LYS . 32.0 m -100.03 -79.2 0.5 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.552 0.691 . . . . 0.0 110.272 175.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.637 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 113.28 57.56 0.41 Allowed Glycine 0 N--CA 1.442 -0.958 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.767 -176.267 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -146.65 178.39 8.33 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 177.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.611 ' HA ' HD11 ' A' ' 80' ' ' LEU . 0.1 OUTLIER -76.29 160.48 29.59 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.383 0.611 . . . . 0.0 111.326 -177.524 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.658 HG12 HG11 ' A' ' 100' ' ' VAL . 2.8 mp -118.65 100.3 51.17 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.542 177.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.626 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 6.4 Cg_exo -75.41 167.78 25.93 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 123.238 2.626 . . . . 0.0 112.029 176.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.84 -16.01 60.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.88 -177.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.07 -17.24 29.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.955 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.626 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 12.6 mp0 -100.42 147.82 25.43 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.338 -177.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.403 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 21.9 mt -103.97 141.72 35.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.031 0.443 . . . . 0.0 111.088 -176.217 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.658 HG11 HG12 ' A' ' 94' ' ' ILE . 0.9 OUTLIER -125.94 147.24 30.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.037 178.121 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.461 ' SD ' ' HA ' ' A' ' 110' ' ' LEU . 0.0 OUTLIER -97.94 112.59 24.46 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.007 0.432 . . . . 0.0 110.308 -179.215 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -82.51 113.12 20.03 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.472 -179.092 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -100.11 -45.51 5.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.675 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.451 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 4.9 mm-40 -154.76 -137.84 0.07 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.102 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.451 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -75.47 -9.59 84.54 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 120.951 -0.643 . . . . 0.0 112.293 179.286 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -105.24 160.58 14.98 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 176.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -118.66 139.4 46.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.209 0.528 . . . . 0.0 111.921 -174.231 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -131.48 168.32 17.84 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 174.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.822 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 73.9 m80 -94.53 -163.92 1.11 Allowed 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.461 ' HA ' ' SD ' ' A' ' 101' ' ' MET . 0.4 OUTLIER -84.03 -20.22 33.09 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.002 0.429 . . . . 0.0 110.977 177.153 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.486 ' NZ ' ' SG ' ' A' ' 90' ' ' CYS . 0.0 OUTLIER -89.79 -22.09 22.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.74 -175.263 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.822 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -94.45 -5.46 46.18 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.156 -173.548 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.63 74.54 4.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.358 0.599 . . . . 0.0 109.616 175.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.606 HG22 ' HG2' ' A' ' 121' ' ' ARG . 38.2 p -127.39 147.8 50.27 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.171 -179.161 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.57 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 7.6 p -71.38 146.58 48.66 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.17 0.509 . . . . 0.0 110.355 177.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.08 -1.79 57.25 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.378 -176.086 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.35 -51.25 3.69 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -175.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.624 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -119.52 -3.71 10.39 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 111.645 0.239 . . . . 0.0 111.645 -175.999 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 70.61 38.98 1.2 Allowed 'General case' 0 C--O 1.233 0.221 0 O-C-N 123.847 0.717 . . . . 0.0 110.6 179.689 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -78.91 128.29 33.11 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.917 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.606 ' HG2' HG22 ' A' ' 114' ' ' THR . 0.2 OUTLIER -78.64 109.08 12.52 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 178.468 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.523 HD22 ' HB2' ' A' ' 128' ' ' PHE . 6.4 mt -67.73 148.59 51.08 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.914 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -136.8 140.28 31.37 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.214 -170.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.718 ' HB3' ' HA ' ' A' ' 407' ' ' PHE . 13.5 Cg_endo -55.77 111.42 0.76 Allowed 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.943 2.428 . . . . 0.0 111.887 178.217 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 108.06 -15.47 36.65 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.311 -176.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -97.55 -179.24 4.4 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.814 ' HD3' ' HG3' ' A' ' 138' ' ' GLU . 0.1 OUTLIER -101.77 143.11 32.1 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.055 0.455 . . . . 0.0 111.462 -171.932 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.523 ' HB2' HD22 ' A' ' 122' ' ' LEU . 1.4 p90 -149.72 151.46 33.69 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.748 176.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' HIS . . . . . 0.637 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 59.9 m-70 -113.29 118.51 34.83 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.033 0.444 . . . . 0.0 110.88 -177.511 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' A' ' 134' ' ' SER . 23.5 t80 -108.36 101.35 10.55 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.879 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.473 HG21 ' O ' ' A' ' 145' ' ' LEU . 2.6 mt -130.64 132.41 64.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.771 179.242 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 55.7 t30 55.38 35.76 25.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.407 0.622 . . . . 0.0 110.449 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.407 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 67.36 35.93 88.33 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.809 178.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.482 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 4.3 m -131.27 151.18 51.74 Favored 'General case' 0 CA--C 1.517 -0.318 0 O-C-N 122.677 -0.308 . . . . 0.0 110.294 -177.529 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.7 mt -101.94 121.32 41.91 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.714 -177.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.637 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 59.7 m-85 -126.51 172.27 10.36 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 175.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 8.9 p -125.24 177.49 6.1 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.727 0.298 . . . . 0.0 110.774 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.814 ' HG3' ' HD3' ' A' ' 127' ' ' ARG . 8.8 mm-40 -77.92 -13.52 59.86 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.013 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -78.14 -33.45 50.38 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.624 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 2.7 p30 -91.92 -48.08 6.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.279 176.018 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.452 HH11 ' HD2' ' A' ' 141' ' ' ARG . 0.0 OUTLIER 43.64 88.23 0.1 Allowed Pre-proline 0 N--CA 1.466 0.331 0 C-N-CA 124.118 0.967 . . . . 0.0 112.993 175.313 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -72.25 72.8 2.77 Favored 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 122.971 2.447 . . . . 0.0 112.041 178.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.41 55.81 0.82 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.469 0.652 . . . . 0.0 111.789 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -147.87 -56.75 0.23 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 175.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.473 ' O ' HG21 ' A' ' 131' ' ' ILE . 0.2 OUTLIER -90.34 71.87 7.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.78 174.721 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -140.73 138.53 35.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.346 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -79.33 66.59 4.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.449 178.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 67.11 33.22 82.67 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 121.156 -0.545 . . . . 0.0 111.854 -177.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 82.12 98.5 0.46 Allowed Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 -176.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -49.42 117.26 2.1 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -174.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 82.34 -37.41 2.58 Favored Glycine 0 C--N 1.333 0.41 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.724 177.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 159.48 46.6 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 110.105 -1.198 . . . . 0.0 110.105 -178.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 16.9 m 60.54 45.69 10.35 Favored 'General case' 0 C--N 1.333 -0.137 0 O-C-N 124.297 0.645 . . . . 0.0 110.756 -174.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 140.43 101.61 0.48 Allowed Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.882 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.48 155.91 20.34 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 47.7 mm -110.0 134.97 50.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.466 -178.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -68.98 121.81 82.93 Favored Pre-proline 0 C--N 1.328 -0.348 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 175.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 406' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -57.54 -90.99 0.0 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.125 2.55 . . . . 0.0 112.905 -175.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 407' ' ' PHE . . . . . 0.718 ' HA ' ' HB3' ' A' ' 124' ' ' PRO . 0.2 OUTLIER -171.78 150.9 2.68 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -178.833 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 408' ' ' PRO . . . . . 0.605 ' HD2' ' CD1' ' A' ' 407' ' ' PHE . 47.8 Cg_endo -72.7 111.25 3.2 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 121.761 1.64 . . . . 0.0 110.723 168.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -120.38 170.36 9.44 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.358 -173.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -92.1 109.96 21.32 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 176.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -84.11 -94.09 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.216 -176.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.408 ' HA ' ' HD2' ' A' ' 413' ' ' PRO . 0.3 OUTLIER -131.24 126.32 21.37 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.895 -177.175 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 413' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 412' ' ' LEU . 21.8 Cg_endo -62.99 125.03 15.04 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.613 2.209 . . . . 0.0 111.292 173.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.717 ' HB ' HD21 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -107.42 162.35 14.0 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.039 -176.06 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 415' ' ' SER . . . . . 0.536 ' HA ' ' HA3' ' A' ' 82' ' ' GLY . 14.1 m 63.77 -151.58 0.31 Allowed 'General case' 0 C--O 1.235 0.291 0 O-C-N 123.568 0.542 . . . . 0.0 110.686 -178.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 416' ' ' HIS . . . . . 0.42 ' HA ' ' HD3' ' A' ' 417' ' ' PRO . 2.7 m-70 -112.27 141.01 24.28 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 174.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 417' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 416' ' ' HIS . 34.2 Cg_exo -60.57 -47.79 12.89 Favored 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.876 2.384 . . . . 0.0 112.861 -177.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.448 -0.787 . . . . 0.0 110.518 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.868 0 N-CA-C 111.807 -0.517 . . . . 0.0 111.807 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 m -86.46 107.08 17.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.23 0.538 . . . . 0.0 110.322 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -80.09 -33.09 39.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.283 -177.057 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 1.5 tt -122.54 122.96 67.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 121.507 0.67 . . . . 0.0 111.923 -175.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -146.61 6.12 0.93 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.603 171.197 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.681 HD12 ' HA ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -96.16 112.98 24.55 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.213 -173.094 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -61.05 -38.75 87.28 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.705 0.764 . . . . 0.0 109.179 175.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -100.83 111.79 4.24 Favored Glycine 0 N--CA 1.441 -0.974 0 N-CA-C 109.855 -1.298 . . . . 0.0 109.855 168.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.681 ' HA ' HD12 ' A' ' 80' ' ' LEU . 0.8 OUTLIER -71.68 12.72 0.33 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -170.051 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.602 ' HB2' ' HB3' ' A' ' 412' ' ' LEU . 0.1 OUTLIER -82.0 -37.12 27.07 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.604 0.24 . . . . 0.0 110.869 178.269 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 176.67 170.11 38.82 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.927 -0.654 . . . . 0.0 111.859 -177.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.508 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -162.45 171.36 17.23 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.946 0.373 . . . . 0.0 110.814 -178.429 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.526 ' HB2' ' CE1' ' A' ' 109' ' ' HIS . 42.1 t -73.16 145.86 46.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.911 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.13 -6.96 59.49 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.997 0.427 . . . . 0.0 110.505 175.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -113.04 -49.89 2.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.067 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 26.9 m -84.4 -28.08 27.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.049 0.452 . . . . 0.0 110.604 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.97 25.9 75.01 Favored Glycine 0 N--CA 1.451 -0.341 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.947 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -115.38 142.08 47.17 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.491 -0.188 . . . . 0.0 110.491 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.7 m -65.55 157.74 28.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.143 176.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.72 ' O ' ' HA ' ' A' ' 413' ' ' PRO . 3.4 mp -113.12 116.69 46.74 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.477 -172.076 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.455 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 6.2 Cg_exo -75.52 165.95 29.52 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.925 2.417 . . . . 0.0 111.192 171.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.72 -16.65 61.66 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.34 0.59 . . . . 0.0 110.505 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.18 -14.77 59.32 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.093 177.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.455 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -109.64 159.57 17.01 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.184 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.3 mt -120.97 146.8 46.29 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.511 0.672 . . . . 0.0 110.931 -176.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.746 HG21 ' HB2' ' A' ' 411' ' ' ALA . 13.9 m -119.76 179.28 2.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.96 -178.183 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.1 mmt -134.09 122.38 22.84 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 174.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.4 105.38 12.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.049 0.452 . . . . 0.0 110.973 -175.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.402 ' HB2' ' HE1' ' A' ' 113' ' ' PHE . . . -88.25 66.75 8.55 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.866 179.42 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 55.7 47.36 20.69 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.368 178.117 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 130.74 -59.63 0.69 Allowed Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.407 178.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -89.99 170.31 10.47 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.886 -0.185 . . . . 0.0 110.553 -178.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -127.33 134.01 66.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.515 0.674 . . . . 0.0 112.42 -174.558 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -116.79 179.13 4.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 169.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.878 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 72.8 m80 -94.99 -164.29 1.15 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 176.02 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.6 tp -79.16 -23.03 44.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.949 0.404 . . . . 0.0 110.9 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.437 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.35 -38.29 13.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.253 0.549 . . . . 0.0 111.35 -176.759 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.878 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.26 -17.66 59.37 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.388 -175.472 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 113' ' ' PHE . . . . . 0.402 ' HE1' ' HB2' ' A' ' 103' ' ' ALA . 0.1 OUTLIER -72.16 77.02 0.96 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.592 0.711 . . . . 0.0 110.327 176.883 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.752 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.9 OUTLIER -145.6 164.05 32.9 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.083 -177.224 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.501 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 19.9 p -77.97 152.56 33.08 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 120.25 -0.58 . . . . 0.0 109.858 176.036 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.9 5.61 50.72 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.236 0.541 . . . . 0.0 110.722 -179.127 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.1 -50.77 3.55 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.804 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.94 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -113.53 -13.06 12.82 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.701 0.286 . . . . 0.0 111.064 178.183 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.501 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 65.45 39.36 5.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.38 -177.602 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 57.2 t30 -86.44 133.16 33.79 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 176.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.752 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.0 OUTLIER -70.32 109.77 4.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.33 -179.01 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.566 HD13 ' HB2' ' A' ' 128' ' ' PHE . 19.8 mt -63.9 149.95 46.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.415 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.55 ' HB ' ' CB ' ' A' ' 126' ' ' ASP . 21.6 t -110.23 130.75 22.52 Favored Pre-proline 0 C--N 1.321 -0.636 0 C-N-CA 120.314 -0.554 . . . . 0.0 110.962 -167.701 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.48 ' HB3' ' HA ' ' A' ' 407' ' ' PHE . 17.9 Cg_endo -58.93 111.5 0.91 Allowed 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.843 2.362 . . . . 0.0 111.046 174.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 92.6 13.75 56.44 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.23 -177.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.55 ' CB ' ' HB ' ' A' ' 123' ' ' VAL . 1.4 t70 -133.09 -172.93 3.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.599 0.238 . . . . 0.0 110.755 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.21 136.55 57.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.059 -0.518 . . . . 0.0 112.31 -174.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.566 ' HB2' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -157.13 144.97 19.1 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.359 -0.837 . . . . 0.0 108.852 172.85 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 129' ' ' HIS . . . . . 0.546 ' O ' ' HA ' ' A' ' 135' ' ' LEU . 66.0 m-70 -118.6 125.99 50.98 Favored 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.752 -178.331 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.477 ' HB2' ' CE2' ' A' ' 128' ' ' PHE . 83.7 t80 -125.4 101.3 6.88 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.294 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -128.84 120.45 52.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.343 -177.404 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.5 t30 59.92 32.75 21.34 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.135 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 74.63 33.29 56.14 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.671 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -133.99 131.76 39.32 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.546 ' HA ' ' O ' ' A' ' 129' ' ' HIS . 6.1 mp -98.93 133.98 42.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.501 -176.424 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.447 ' HA ' ' CB ' ' A' ' 115' ' ' CYS . 21.0 m-85 -136.85 166.03 24.58 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.544 178.012 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 16.4 p -109.27 -168.45 1.34 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.913 0.387 . . . . 0.0 110.839 178.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -77.64 -26.71 50.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.472 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -73.55 -42.31 61.85 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.563 -175.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.94 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 0.6 OUTLIER -101.19 -2.17 32.0 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.469 -176.59 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 141' ' ' ARG . 32.0 ttt-85 -29.69 105.61 0.22 Allowed Pre-proline 0 N--CA 1.478 0.931 0 O-C-N 124.517 1.136 . . . . 0.0 113.336 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -79.06 88.78 1.42 Allowed 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 123.242 2.628 . . . . 0.0 112.301 178.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.52 -30.67 61.12 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.485 -0.779 . . . . 0.0 112.708 -176.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -75.08 -15.77 60.6 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -175.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 145' ' ' LEU . 1.0 OUTLIER -91.87 -22.39 20.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.818 0.342 . . . . 0.0 111.222 -175.95 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -114.36 160.29 13.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.562 -177.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -85.47 62.57 7.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.437 0.637 . . . . 0.0 109.432 178.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 73.58 6.38 71.02 Favored Glycine 0 N--CA 1.452 -0.282 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.944 -176.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 72.28 -97.69 0.78 Allowed Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -175.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 58.6 p -125.65 11.7 7.92 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.203 0.525 . . . . 0.0 109.772 174.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 81.02 52.11 4.45 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 -174.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 143.14 -42.82 1.06 Allowed Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 111.289 -0.725 . . . . 0.0 111.289 -176.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -129.45 -152.23 0.51 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 207' ' ' GLY . . . . . 0.414 ' HA3' ' CE1' ' A' ' 129' ' ' HIS . . . -135.45 -106.22 0.85 Allowed Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 111.066 -0.814 . . . . 0.0 111.066 176.463 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -116.2 169.52 9.22 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 173.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 50.9 mm -114.44 126.13 71.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 405' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 123' ' ' VAL . . . -66.87 134.87 94.09 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.909 -177.619 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 406' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 20.0 Cg_exo -67.01 -176.19 0.73 Allowed 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 123.082 2.521 . . . . 0.0 111.715 176.688 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 407' ' ' PHE . . . . . 0.48 ' HA ' ' HB3' ' A' ' 124' ' ' PRO . 27.6 m-85 -107.94 163.46 16.91 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.942 -179.164 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -54.35 116.78 3.3 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.551 2.167 . . . . 0.0 111.704 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.7 177.53 4.64 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.123 -176.216 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -116.6 121.81 42.79 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 174.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 411' ' ' ALA . . . . . 0.746 ' HB2' HG21 ' A' ' 100' ' ' VAL . . . -90.88 -141.35 0.17 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.875 0.369 . . . . 0.0 111.244 -176.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.602 ' HB3' ' HB2' ' A' ' 84' ' ' SER . 0.0 OUTLIER -90.96 113.25 57.49 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.136 -179.41 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 413' ' ' PRO . . . . . 0.72 ' HA ' ' O ' ' A' ' 94' ' ' ILE . 14.6 Cg_endo -57.77 151.04 58.59 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.997 2.465 . . . . 0.0 113.173 -178.38 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 3.2 m -71.17 129.82 39.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.265 -178.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.44 106.95 1.52 Allowed 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 174.086 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 416' ' ' HIS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 417' ' ' PRO . 17.8 m170 -77.91 137.5 61.83 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.962 -175.728 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 417' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 416' ' ' HIS . 24.2 Cg_exo -63.93 143.28 84.96 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.203 2.602 . . . . 0.0 112.677 -177.306 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 16.1 tttm . . . . . 0 C--O 1.248 0.998 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.382 -179.511 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.682 0 N-CA-C 111.486 -0.646 . . . . 0.0 111.486 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -140.77 154.58 46.34 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 -179.325 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -62.49 -52.7 62.47 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.269 0.557 . . . . 0.0 109.674 177.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -91.89 122.79 43.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.302 176.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.71 -32.66 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.153 -0.931 . . . . 0.0 108.576 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.587 HD23 ' H ' ' A' ' 80' ' ' LEU . 1.3 pt? -96.2 28.98 2.98 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.195 176.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.404 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.3 OUTLIER 52.64 74.69 0.27 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.99 -179.76 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 92.56 -125.63 8.21 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.222 -173.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.551 ' HA ' HD11 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -162.02 66.78 0.25 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.234 0.54 . . . . 0.0 110.4 178.914 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.38 -72.47 0.7 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.046 178.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -141.7 142.87 12.34 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 121.186 -0.531 . . . . 0.0 111.916 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -137.67 158.86 43.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.969 0.414 . . . . 0.0 110.91 -178.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.506 ' HB2' ' CE1' ' A' ' 109' ' ' HIS . 38.0 t -85.89 144.92 27.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.349 177.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.32 -4.0 58.6 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.882 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.422 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -117.11 -47.59 2.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.488 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 57.0 m -82.6 -40.64 20.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.852 0.358 . . . . 0.0 111.276 -179.28 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 85.57 9.16 79.23 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 110.814 -0.915 . . . . 0.0 110.814 -172.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.493 ' NE2' ' H ' ' A' ' 93' ' ' SER . 0.0 OUTLIER -93.88 164.7 13.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.366 -0.417 . . . . 0.0 109.953 179.213 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.493 ' H ' ' NE2' ' A' ' 92' ' ' GLN . 0.0 OUTLIER -82.03 171.28 14.57 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.059 0.457 . . . . 0.0 111.218 -179.831 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.763 HG12 HG11 ' A' ' 100' ' ' VAL . 2.6 mp -114.77 105.31 53.48 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.372 175.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -73.8 159.12 45.87 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.767 2.311 . . . . 0.0 112.076 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.52 ' HB2' ' HB3' ' A' ' 413' ' ' PRO . . . -71.91 -13.08 61.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.975 0.416 . . . . 0.0 111.118 -178.711 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.74 12.26 32.62 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.926 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -123.2 157.04 33.91 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.221 0.534 . . . . 0.0 110.718 -179.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.6 mt -114.68 130.03 56.76 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.314 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.763 HG11 HG12 ' A' ' 94' ' ' ILE . 13.2 m -129.66 168.06 23.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.773 -175.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -112.11 141.13 46.18 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.022 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.2 136.35 49.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.361 -178.372 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -150.97 121.83 7.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.684 -0.234 . . . . 0.0 110.998 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 70.2 -2.64 2.04 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.162 0.585 . . . . 0.0 111.733 176.3 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 115.83 -16.09 16.29 Favored Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -175.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -89.97 163.92 14.76 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -124.4 140.21 48.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.034 0.445 . . . . 0.0 111.669 -177.273 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' TYR . . . . . 0.549 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 98.2 m-85 -131.09 167.49 19.01 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.366 -0.833 . . . . 0.0 108.771 175.148 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.798 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 72.5 m80 -92.73 -159.14 0.65 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 176.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 5.0 mt -85.29 -22.0 28.75 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.994 0.426 . . . . 0.0 111.37 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.63 -35.61 14.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.939 0.4 . . . . 0.0 111.763 -176.067 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.798 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.5 -16.66 59.59 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.207 -175.678 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.66 64.53 6.41 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.397 177.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.684 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.6 OUTLIER -131.14 152.47 50.4 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.774 -179.67 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.472 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 5.0 t -64.23 132.21 49.63 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 175.797 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 3.4 m -82.27 2.47 31.83 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.548 -176.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -106.03 -49.38 3.39 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -176.157 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.527 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 28.2 p -112.04 -14.42 13.45 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.055 0.455 . . . . 0.0 110.654 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.472 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 73.8 23.81 2.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.287 -179.034 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ASN . . . . . 0.527 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 3.2 m-80 -65.88 133.63 51.33 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 170.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.684 ' HA ' HG22 ' A' ' 114' ' ' THR . 10.7 tpp85 -75.29 119.55 19.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.243 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.638 HD11 ' HB3' ' A' ' 135' ' ' LEU . 23.6 mt -58.89 137.19 57.93 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -115.27 132.38 23.09 Favored Pre-proline 0 C--N 1.321 -0.641 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.309 -165.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.47 ' HB2' ' CE2' ' A' ' 407' ' ' PHE . 19.9 Cg_endo -60.63 111.7 1.12 Allowed 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.628 2.219 . . . . 0.0 110.992 175.314 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 110.29 -4.48 29.89 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.604 -0.807 . . . . 0.0 112.045 -178.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.404 ' O ' ' HA ' ' A' ' 404' ' ' ILE . 1.0 OUTLIER -124.45 -177.76 3.9 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 177.203 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.521 ' HD2' ' HG3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -90.5 149.71 22.09 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.385 0.612 . . . . 0.0 112.348 -172.176 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.531 ' HB2' HD22 ' A' ' 122' ' ' LEU . 5.8 p90 -144.91 147.19 32.47 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.946 -1.025 . . . . 0.0 108.577 172.05 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -112.73 113.75 26.0 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.12 0.486 . . . . 0.0 110.973 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.488 ' CE2' ' HA2' ' A' ' 133' ' ' GLY . 3.8 t80 -92.66 101.1 13.5 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 175.324 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 28.1 mm -112.56 115.06 48.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.937 -176.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.5 t30 54.41 35.72 23.79 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 123.657 0.598 . . . . 0.0 111.288 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.488 ' HA2' ' CE2' ' A' ' 130' ' ' TYR . . . 80.24 30.11 42.88 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.938 177.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.417 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 0.7 OUTLIER -133.92 146.64 50.7 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.733 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.638 ' HB3' HD11 ' A' ' 122' ' ' LEU . 3.1 mt -95.37 118.98 33.08 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.865 0.364 . . . . 0.0 110.848 -177.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.417 ' CE2' ' HB2' ' A' ' 134' ' ' SER . 69.0 m-85 -126.85 159.66 33.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.939 176.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' CYS . . . . . 0.526 ' SG ' ' HB2' ' A' ' 140' ' ' ASP . 14.4 p -101.02 169.91 8.63 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.442 -178.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.521 ' HG3' ' HD2' ' A' ' 127' ' ' ARG . 1.5 mm-40 -77.9 -17.7 56.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.267 0.556 . . . . 0.0 110.264 174.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -20.76 58.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.622 0.725 . . . . 0.0 109.222 179.488 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.526 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 0.4 OUTLIER -104.07 -67.86 0.88 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.995 178.567 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 52.51 89.66 0.1 OUTLIER Pre-proline 0 N--CA 1.466 0.355 0 C-N-CA 123.468 0.707 . . . . 0.0 112.376 178.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -58.19 99.42 0.1 OUTLIER 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.047 2.498 . . . . 0.0 112.405 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.83 -26.64 63.37 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.96 -176.372 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.69 -39.84 95.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.774 -177.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.2 mt -152.28 90.87 1.54 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.501 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.476 ' H ' HG13 ' A' ' 146' ' ' ILE . 0.1 OUTLIER -99.66 46.36 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.956 -179.869 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -76.24 95.17 3.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.078 0.466 . . . . 0.0 110.322 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 159.68 -37.91 0.47 Allowed Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 110.659 -0.977 . . . . 0.0 110.659 -179.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -107.29 150.15 16.75 Favored Glycine 0 N--CA 1.45 -0.428 0 N-CA-C 111.598 -0.601 . . . . 0.0 111.598 176.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.37 19.33 1.25 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 121.177 0.513 . . . . 0.0 110.943 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 125.3 -93.8 0.44 Allowed Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 111.073 -0.811 . . . . 0.0 111.073 -176.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -132.7 47.94 0.98 Allowed Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 110.761 -0.936 . . . . 0.0 110.761 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.97 -38.53 88.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.891 0.377 . . . . 0.0 110.903 -178.302 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 84.32 80.4 1.06 Allowed Glycine 0 N--CA 1.442 -0.952 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.73 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -76.01 118.05 18.36 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 173.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 404' ' ' ILE . . . . . 0.404 ' HA ' ' O ' ' A' ' 126' ' ' ASP . 30.2 mm -81.54 138.95 18.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.938 -174.338 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -57.9 128.72 81.22 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.391 176.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 406' ' ' PRO . . . . . 0.606 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 38.1 Cg_endo -66.98 -5.46 13.56 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.383 2.722 . . . . 0.0 113.93 -174.131 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 407' ' ' PHE . . . . . 0.606 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 21.0 m-85 78.06 156.59 0.14 Allowed Pre-proline 0 N--CA 1.468 0.434 0 O-C-N 124.011 0.819 . . . . 0.0 109.935 -178.145 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.95 128.56 10.06 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.42 2.08 . . . . 0.0 112.203 176.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -140.44 177.21 8.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.585 176.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -86.29 125.63 33.74 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.784 0.326 . . . . 0.0 110.871 -179.462 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -91.92 -143.03 0.19 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.165 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 13.3 mt -85.35 116.55 66.01 Favored Pre-proline 0 N--CA 1.452 -0.369 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 177.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 413' ' ' PRO . . . . . 0.52 ' HB3' ' HB2' ' A' ' 96' ' ' ALA . 24.6 Cg_exo -63.75 154.82 67.18 Favored 'Trans proline' 0 C--O 1.237 0.453 0 C-N-CA 122.818 2.346 . . . . 0.0 112.84 -178.347 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.404 HG21 ' HB3' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -69.25 154.61 41.76 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.259 179.775 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 5.9 m -69.7 138.55 52.99 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.174 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 416' ' ' HIS . . . . . 0.49 ' HA ' ' HD3' ' A' ' 417' ' ' PRO . 17.5 t60 -72.75 114.26 28.75 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.167 177.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 417' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 416' ' ' HIS . 2.8 Cg_endo -80.05 58.56 7.04 Favored 'Trans proline' 0 C--O 1.237 0.429 0 C-N-CA 123.247 2.631 . . . . 0.0 112.625 -175.292 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.079 0 CA-C-O 117.97 -1.014 . . . . 0.0 109.799 175.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.874 0 N-CA-C 111.866 -0.493 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.431 ' HB2' HG13 ' A' ' 78' ' ' ILE . 0.0 OUTLIER -131.26 140.76 49.89 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.299 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 7.8 p90 -71.79 -19.53 61.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.818 0.342 . . . . 0.0 111.21 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.431 HG13 ' HB2' ' A' ' 2' ' ' SER . 0.6 OUTLIER -79.42 100.3 3.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.148 0.499 . . . . 0.0 110.728 178.482 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.456 ' HB3' ' HB1' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -97.4 6.48 48.17 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.534 0.683 . . . . 0.0 110.015 179.693 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.842 HD13 ' HA ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -121.56 113.71 20.17 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.607 -172.627 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -61.2 -35.56 77.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.32 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -124.3 26.43 5.79 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.149 -0.548 . . . . 0.0 111.963 179.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.842 ' HA ' HD13 ' A' ' 80' ' ' LEU . 2.7 t-20 69.41 161.73 0.21 Allowed 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.509 0.724 . . . . 0.0 112.801 178.143 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.447 ' N ' HD22 ' A' ' 80' ' ' LEU . 51.4 m 71.76 -61.15 0.5 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.008 -0.996 . . . . 0.0 113.46 174.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -89.23 122.2 6.36 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.547 -0.835 . . . . 0.0 113.22 -174.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.517 ' HA ' ' HA ' ' A' ' 93' ' ' SER . . . -168.29 133.42 1.76 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.578 0.228 . . . . 0.0 111.127 177.282 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.33 133.57 34.04 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 171.442 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.7 m -86.66 8.66 21.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.052 -0.522 . . . . 0.0 112.229 -172.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.722 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -98.17 -59.53 1.74 Allowed 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.082 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 26.1 p -86.42 -60.08 2.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.254 0.549 . . . . 0.0 110.609 -177.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.44 ' HA2' ' HE ' ' A' ' 79' ' ' ARG . . . 133.07 -2.8 4.79 Favored Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.739 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -82.19 122.24 27.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.902 0.382 . . . . 0.0 110.279 178.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.582 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.9 OUTLIER -63.13 128.03 33.96 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.809 172.833 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.442 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 1.7 mt -65.31 119.66 61.17 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.789 -174.266 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 94' ' ' ILE . 2.9 Cg_exo -76.88 166.9 26.17 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.25 2.633 . . . . 0.0 111.817 176.563 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.42 0.85 18.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.931 0.396 . . . . 0.0 111.499 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.18 21.39 14.22 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.875 179.522 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -135.88 160.31 38.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.739 179.019 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.1 mp -120.86 150.55 40.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.336 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.9 157.4 42.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.939 -178.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.0 126.78 52.6 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.078 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 102' ' ' ARG . 10.1 mtt-85 -91.48 97.77 11.27 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.412 ' HB2' ' CE1' ' A' ' 113' ' ' PHE . . . -64.68 -59.07 4.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.752 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.3 91.12 0.37 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.004 179.163 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 82.09 -52.69 4.66 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.012 -0.613 . . . . 0.0 112.292 -176.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -90.97 158.66 16.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.586 0.231 . . . . 0.0 111.285 -178.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -118.09 144.24 26.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.9 0.381 . . . . 0.0 111.072 -177.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -137.0 163.74 30.01 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.672 177.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.784 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 12.4 m80 -79.49 170.82 16.01 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.824 0.345 . . . . 0.0 110.773 -179.319 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.38 -31.61 72.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.821 177.709 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.535 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.48 -30.83 18.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.122 0.487 . . . . 0.0 110.551 178.609 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.784 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 34.0 m -79.0 -13.74 59.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.148 -178.131 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' PHE . . . . . 0.412 ' CE1' ' HB2' ' A' ' 103' ' ' ALA . 0.0 OUTLIER -76.18 76.03 3.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.091 174.053 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.576 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.7 OUTLIER -133.79 149.7 51.42 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.115 -178.425 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.444 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 5.5 p -74.53 155.16 38.22 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.142 0.496 . . . . 0.0 111.174 -179.376 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 1.5 m -79.68 -45.68 18.53 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.248 -175.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.74 -51.57 39.93 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -171.222 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.79 -14.65 16.53 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 121.051 -0.259 . . . . 0.0 111.196 -175.382 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.444 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 69.41 31.65 3.74 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.88 -176.819 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -83.4 146.96 28.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.639 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.576 ' HA ' HG22 ' A' ' 114' ' ' THR . 9.0 ttt180 -85.84 135.47 33.7 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.879 0.371 . . . . 0.0 111.313 -175.438 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.732 HD22 ' HB2' ' A' ' 128' ' ' PHE . 9.0 mt -81.75 125.71 30.96 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 38.6 t -122.56 138.38 29.21 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.621 -170.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.43 111.41 0.93 Allowed 'Trans proline' 0 N--CA 1.463 -0.277 0 C-N-CA 122.406 2.07 . . . . 0.0 111.072 174.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 114.34 -21.36 15.06 Favored Glycine 0 N--CA 1.446 -0.641 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 -173.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.47 176.02 5.49 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.746 ' HB2' ' HB2' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -102.46 135.83 43.38 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.703 0.287 . . . . 0.0 111.363 -173.807 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.732 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -132.52 159.6 38.95 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.027 179.322 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 129' ' ' HIS . . . . . 0.564 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 78.1 m-70 -130.09 140.58 50.8 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.774 0.321 . . . . 0.0 110.528 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.422 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 10.7 t80 -125.28 101.98 7.23 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 178.289 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 7.6 mt -121.84 111.33 30.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 120.732 0.301 . . . . 0.0 110.649 -176.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 51.7 t30 57.87 51.13 9.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.667 179.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.422 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 62.19 35.58 91.74 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.736 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 2.6 m -133.38 138.85 46.48 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -177.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 24.3 mt -92.67 125.34 37.25 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.975 -175.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.564 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 76.5 m-85 -129.43 161.96 29.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.055 176.566 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' CYS . . . . . 0.513 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 17.1 p -111.07 -176.14 2.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.953 0.406 . . . . 0.0 111.298 -175.655 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.746 ' HB2' ' HB2' ' A' ' 127' ' ' ARG . 0.0 OUTLIER -71.56 -32.94 68.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.871 176.661 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -68.11 -34.42 76.34 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 177.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.513 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.7 OUTLIER -66.35 -77.73 0.06 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.271 175.47 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 44.18 70.59 1.83 Allowed Pre-proline 0 CA--C 1.529 0.15 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.855 -176.554 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.4 ' O ' HG22 ' A' ' 146' ' ' ILE . 8.9 Cg_exo -72.09 78.66 1.81 Allowed 'Trans proline' 0 C--O 1.236 0.394 0 C-N-CA 122.762 2.308 . . . . 0.0 111.786 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 18.4 m -57.79 -41.2 81.63 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.993 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -71.62 -24.28 61.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.945 0.402 . . . . 0.0 111.45 -177.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -79.79 -52.66 7.64 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.1 -178.116 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.426 ' O ' HG13 ' A' ' 146' ' ' ILE . 0.8 OUTLIER -90.73 -22.79 6.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.728 -175.526 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 59.41 48.25 10.16 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.345 0.593 . . . . 0.0 110.795 -176.692 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 168.1 -92.12 0.1 Allowed Glycine 0 N--CA 1.453 -0.227 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.443 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 146.06 63.37 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.54 -0.838 . . . . 0.0 112.933 177.149 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 1.1 m 39.68 63.24 1.05 Allowed 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 176.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 91.92 -88.35 1.35 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.485 -0.864 . . . . 0.0 112.939 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -111.28 49.55 0.84 Allowed Glycine 0 N--CA 1.454 -0.114 0 C-N-CA 120.74 -0.743 . . . . 0.0 113.503 -173.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 3.4 m 60.35 28.1 17.71 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.063 0.458 . . . . 0.0 112.034 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 133.72 101.66 0.75 Allowed Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.98 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.48 144.91 28.42 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.866 0.365 . . . . 0.0 110.811 -178.415 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 28.4 mm -79.43 141.74 14.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 177.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 405' ' ' ALA . . . . . 0.462 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -50.25 127.06 22.24 Favored Pre-proline 0 N--CA 1.462 0.128 0 O-C-N 123.289 0.368 . . . . 0.0 111.025 177.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 406' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 15.3 Cg_exo -69.45 10.29 0.46 Allowed 'Trans proline' 0 N--CA 1.475 0.44 0 C-N-CA 123.733 2.956 . . . . 0.0 114.023 -171.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 407' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 15.1 m-85 70.34 158.54 0.16 Allowed Pre-proline 0 N--CA 1.466 0.355 0 O-C-N 123.554 0.534 . . . . 0.0 111.741 176.023 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -83.89 149.38 12.4 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.647 2.232 . . . . 0.0 112.915 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -155.13 160.74 41.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.441 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -78.19 124.59 28.25 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 176.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -94.45 -139.48 0.23 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.288 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.1 OUTLIER -91.45 111.79 50.86 Favored Pre-proline 0 C--N 1.329 -0.286 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 175.396 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 413' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 28.8 Cg_exo -61.75 132.18 38.88 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.512 2.141 . . . . 0.0 112.16 -179.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.582 HG21 ' HB3' ' A' ' 93' ' ' SER . 1.0 OUTLIER -70.64 139.03 51.22 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.407 -179.22 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 415' ' ' SER . . . . . 0.412 ' O ' ' HD3' ' A' ' 417' ' ' PRO . 0.9 OUTLIER 71.73 152.99 0.12 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.777 0.831 . . . . 0.0 111.845 177.85 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 9.4 m170 -106.36 98.96 21.52 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.292 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 417' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 415' ' ' SER . 19.2 Cg_endo -91.72 24.99 0.5 Allowed 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.521 2.814 . . . . 0.0 112.605 -176.269 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.845 0 CA-C-O 118.781 -0.628 . . . . 0.0 109.832 -179.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.672 0 N-CA-C 112.298 -0.321 . . . . 0.0 112.298 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 m 54.25 50.9 15.4 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.372 0.669 . . . . 0.0 111.939 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -87.64 -30.91 20.08 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.138 0.494 . . . . 0.0 109.976 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 7.9 tt -158.07 129.99 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.646 179.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.0 ttt85 -151.21 33.03 0.58 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.31 0.576 . . . . 0.0 109.793 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.719 HD21 ' HA ' ' A' ' 83' ' ' ASN . 0.4 OUTLIER -154.76 -176.72 6.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.116 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -82.26 72.04 9.32 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.54 0.686 . . . . 0.0 110.067 176.52 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 125.29 -117.65 3.03 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.413 -178.02 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.719 ' HA ' HD21 ' A' ' 80' ' ' LEU . 1.4 t-20 -159.32 175.49 13.31 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 178.774 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 10.5 m 62.09 73.29 0.47 Allowed 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.88 0.737 . . . . 0.0 112.04 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLY . . . . . 0.505 ' HA3' HG22 ' A' ' 414' ' ' THR . . . 128.59 83.41 0.37 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.191 -1.004 . . . . 0.0 112.978 175.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.563 ' HB2' HD22 ' A' ' 80' ' ' LEU . . . -148.25 144.37 27.61 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.629 -0.336 . . . . 0.0 110.181 178.181 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 4.7 t -66.65 142.62 57.39 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.693 177.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.585 ' HB2' ' CE1' ' A' ' 108' ' ' TYR . 0.7 OUTLIER -95.13 8.37 43.21 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.677 174.637 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.706 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -118.42 -59.7 1.86 Allowed 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.622 -179.231 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.431 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 31.1 p -91.09 -73.97 0.52 Allowed 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.167 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.431 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 129.56 61.02 0.1 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.548 176.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -137.52 150.51 47.58 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.6 0.238 . . . . 0.0 110.374 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.0 119.71 14.62 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.972 176.554 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.5 mp -76.54 120.23 80.79 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.785 -174.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.43 ' HD2' ' HB3' ' A' ' 98' ' ' GLU . 5.7 Cg_exo -77.74 166.24 25.69 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.524 2.816 . . . . 0.0 111.778 173.461 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.23 -21.05 61.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.962 0.411 . . . . 0.0 110.982 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.42 -13.66 58.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.282 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.43 ' HB3' ' HD2' ' A' ' 95' ' ' PRO . 15.1 tt0 -106.38 121.08 43.53 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.038 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 21.2 mt -84.75 139.3 32.07 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.552 -178.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.449 ' O ' ' HA ' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -115.09 144.59 22.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.945 -178.229 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.439 ' SD ' ' HG ' ' A' ' 110' ' ' LEU . 0.0 OUTLIER -91.81 120.26 32.36 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.993 179.965 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.513 ' HD2' HG13 ' A' ' 107' ' ' VAL . 8.3 tpt180 -96.74 108.76 21.46 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.034 -177.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -82.34 -40.22 21.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.055 0.455 . . . . 0.0 110.152 175.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.469 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -174.34 -106.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.582 176.747 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.469 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -76.69 -30.19 56.57 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.603 -0.808 . . . . 0.0 111.719 176.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -89.38 159.48 17.3 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.714 0.292 . . . . 0.0 110.974 -176.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.513 HG13 ' HD2' ' A' ' 102' ' ' ARG . 0.1 OUTLIER -128.99 135.91 60.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.834 -179.738 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 108' ' ' TYR . . . . . 0.585 ' CE1' ' HB2' ' A' ' 88' ' ' SER . 74.3 m-85 -135.92 164.79 27.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.445 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.843 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 19.4 m80 -92.32 172.33 8.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.537 179.169 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.667 HD21 ' HG3' ' A' ' 408' ' ' PRO . 0.5 OUTLIER -65.15 -30.96 71.92 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.341 0.591 . . . . 0.0 110.665 175.232 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.443 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 2.4 pttt -90.11 -13.51 35.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.85 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.843 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 35.4 m -103.77 -20.76 13.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.126 -173.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' PHE . . . . . 0.529 ' HD1' ' HA ' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -64.85 98.27 0.27 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.269 177.669 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.595 HG22 ' HA ' ' A' ' 121' ' ' ARG . 2.8 p -147.7 160.88 42.21 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -178.271 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 9.1 p -83.89 153.18 24.13 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 120.815 0.341 . . . . 0.0 110.296 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.16 -16.12 59.25 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.308 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.76 -51.05 5.71 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -173.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.797 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -112.85 -15.63 12.87 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.771 -0.371 . . . . 0.0 111.322 -178.024 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 67.69 36.31 3.68 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 123.624 0.577 . . . . 0.0 110.161 -176.184 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -73.81 123.51 24.32 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 175.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.595 ' HA ' HG22 ' A' ' 114' ' ' THR . 1.4 mtm180 -74.78 106.46 6.33 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.884 0.374 . . . . 0.0 110.744 -175.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.625 HD22 ' HB2' ' A' ' 128' ' ' PHE . 2.7 mt -66.1 133.94 51.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.007 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 14.8 t -132.85 142.28 44.13 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.695 -171.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_exo -57.09 109.56 0.47 Allowed 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 121.86 1.706 . . . . 0.0 110.72 173.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 117.39 -13.56 13.63 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.561 -174.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -108.29 169.04 8.88 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 175.622 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.507 ' HB2' ' HB3' ' A' ' 138' ' ' GLU . 8.6 mtt85 -100.49 145.61 28.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.958 0.409 . . . . 0.0 111.374 -174.421 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.625 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.4 OUTLIER -148.34 171.94 15.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.883 -179.799 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 129' ' ' HIS . . . . . 0.452 ' CE1' ' HA2' ' A' ' 207' ' ' GLY . 1.7 m80 -140.92 139.62 34.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.042 0.449 . . . . 0.0 111.282 178.262 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.624 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 46.6 t80 -124.26 103.24 8.12 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.505 HD12 ' CD2' ' A' ' 136' ' ' PHE . 13.5 mt -115.56 105.35 18.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.258 -175.354 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 64.4 24.56 13.23 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.033 174.003 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.624 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 92.94 31.86 8.31 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.614 -179.316 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.14 138.93 45.55 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.481 HD23 ' HD1' ' A' ' 130' ' ' TYR . 21.9 mt -96.94 127.74 43.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.957 0.408 . . . . 0.0 111.643 -176.431 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.505 ' CD2' HD12 ' A' ' 131' ' ' ILE . 72.9 m-85 -135.0 160.9 36.84 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 173.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' CYS . . . . . 0.606 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 23.7 p -101.79 -171.76 2.03 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.193 0.521 . . . . 0.0 110.461 179.48 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.507 ' HB3' ' HB2' ' A' ' 127' ' ' ARG . 3.6 pt-20 -77.31 -21.44 53.49 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.176 177.193 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' HIS . . . . . 0.606 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 72.7 t60 -82.15 -40.84 21.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.485 -175.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.797 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 0.1 OUTLIER -103.24 9.84 37.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.224 -178.005 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.424 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 15.1 ttp180 -43.9 110.84 1.03 Allowed Pre-proline 0 N--CA 1.468 0.456 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.217 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 6.3 Cg_exo -78.88 107.07 2.19 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 123.279 2.652 . . . . 0.0 112.2 -178.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 16.0 m -79.29 -20.41 48.09 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.166 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.92 -57.45 8.74 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 121.016 0.436 . . . . 0.0 110.462 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 1.7 mp -116.11 81.69 1.65 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.77 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.411 ' HB ' ' O ' ' A' ' 142' ' ' PRO . 1.4 tt -110.89 144.51 18.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.299 -174.653 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ASN . . . . . 0.494 ' H ' HG12 ' A' ' 131' ' ' ILE . 56.6 t-20 -69.85 -64.5 0.87 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.942 176.081 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -119.55 90.57 0.48 Allowed Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.895 -0.669 . . . . 0.0 111.703 178.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -113.49 95.27 0.75 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.964 -0.636 . . . . 0.0 111.998 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -106.36 2.43 26.54 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.318 0.58 . . . . 0.0 110.747 -178.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 124.53 -101.89 0.68 Allowed Glycine 0 N--CA 1.447 -0.571 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -176.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -79.71 50.4 3.84 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.793 -0.717 . . . . 0.0 111.528 176.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -93.17 156.05 17.09 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.209 0.528 . . . . 0.0 111.293 -177.145 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 207' ' ' GLY . . . . . 0.452 ' HA2' ' CE1' ' A' ' 129' ' ' HIS . . . 161.07 84.37 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 -175.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.88 134.86 56.87 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.049 0.452 . . . . 0.0 112.116 -173.349 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 43.4 mm -66.94 136.56 26.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.623 174.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -52.98 124.95 38.92 Favored Pre-proline 0 C--N 1.331 -0.226 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 176.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 406' ' ' PRO . . . . . 0.446 ' O ' ' HD1' ' A' ' 407' ' ' PHE . 78.7 Cg_exo -46.31 -82.67 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.576 2.85 . . . . 0.0 113.136 -172.606 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 407' ' ' PHE . . . . . 0.629 ' CD2' ' HD2' ' A' ' 408' ' ' PRO . 0.2 OUTLIER 169.8 150.64 0.14 Allowed Pre-proline 0 C--N 1.329 -0.293 0 C-N-CA 123.437 0.695 . . . . 0.0 109.181 177.054 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 408' ' ' PRO . . . . . 0.667 ' HG3' HD21 ' A' ' 110' ' ' LEU . 87.0 Cg_endo -85.69 129.7 3.61 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.443 2.096 . . . . 0.0 112.606 174.658 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -139.53 164.04 30.95 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 177.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -74.71 110.87 9.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.679 0.276 . . . . 0.0 110.441 179.117 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -84.2 -90.78 0.09 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.941 -176.515 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -131.4 130.79 22.63 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.564 -176.004 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.18 131.64 35.39 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.843 2.362 . . . . 0.0 111.328 173.462 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.505 HG22 ' HA3' ' A' ' 85' ' ' GLY . 68.1 p -110.01 169.22 8.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.871 -172.366 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 415' ' ' SER . . . . . 0.431 ' HB2' ' H ' ' A' ' 416' ' ' HIS . 0.8 OUTLIER 56.03 -124.35 1.95 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.867 177.166 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 416' ' ' HIS . . . . . 0.431 ' H ' ' HB2' ' A' ' 415' ' ' SER . 0.2 OUTLIER -117.12 126.56 27.35 Favored Pre-proline 0 C--N 1.329 -0.307 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -178.794 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 417' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 416' ' ' HIS . 14.8 Cg_exo -69.91 -31.92 18.93 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.843 2.362 . . . . 0.0 112.116 179.022 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.412 -0.804 . . . . 0.0 110.889 -179.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.524 0 N-CA-C 112.156 -0.377 . . . . 0.0 112.156 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -95.95 26.76 3.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.21 0.528 . . . . 0.0 111.07 -177.692 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -95.19 15.68 18.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.146 0.498 . . . . 0.0 110.265 178.471 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 24.5 mm -94.47 95.3 5.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.559 -176.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -111.83 16.64 20.34 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 175.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.798 HD12 ' H ' ' A' ' 84' ' ' SER . 1.2 pt? -147.82 123.11 10.26 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.911 -1.04 . . . . 0.0 108.934 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -51.83 -60.02 3.65 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 123.622 0.576 . . . . 0.0 110.433 -175.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.72 124.44 8.02 Favored Glycine 0 N--CA 1.44 -1.068 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 168.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -65.01 87.51 0.06 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 117.069 0.434 . . . . 0.0 110.119 -179.006 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.798 ' H ' HD12 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -148.76 -58.68 0.22 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.402 -178.727 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLY . . . . . 0.43 ' H ' HG23 ' A' ' 414' ' ' THR . . . -150.57 163.29 29.57 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 121.035 -0.602 . . . . 0.0 111.858 179.149 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.634 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -167.11 162.19 15.15 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.95 143.92 26.09 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.54 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.99 14.44 6.16 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -172.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.614 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -112.01 -58.23 2.16 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 121.055 -0.258 . . . . 0.0 111.28 179.504 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.529 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 32.0 p -95.32 -72.85 0.61 Allowed 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.47 -175.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.529 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 130.65 6.78 3.62 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 111.751 -0.54 . . . . 0.0 111.751 -176.711 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -83.99 117.81 23.63 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 174.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.762 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.7 OUTLIER -62.59 124.28 20.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.703 -177.745 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.4 mt -64.85 111.33 5.57 Favored Pre-proline 0 C--N 1.329 -0.312 0 O-C-N 123.685 0.616 . . . . 0.0 112.119 -171.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.563 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 8.0 Cg_exo -73.63 168.15 25.49 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 123.064 2.509 . . . . 0.0 111.111 173.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.87 -0.49 11.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.868 0.366 . . . . 0.0 111.346 -178.248 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -116.59 13.25 15.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.009 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.563 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.6 OUTLIER -115.62 142.86 46.17 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.458 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.3 mp -109.64 138.74 45.56 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.291 -177.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -120.21 146.96 24.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.558 -178.166 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.489 ' SD ' ' HG3' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -94.98 113.01 24.67 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.864 179.434 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.51 ' H ' ' HG3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -91.25 102.68 15.39 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.721 -177.898 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -78.93 -35.26 43.61 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.299 0.571 . . . . 0.0 110.163 176.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -148.98 -128.72 0.05 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.323 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -91.19 10.07 75.91 Favored Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 110.988 -0.845 . . . . 0.0 110.988 172.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -120.14 143.81 48.0 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.188 -0.506 . . . . 0.0 109.837 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -113.72 140.8 32.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.296 0.57 . . . . 0.0 112.411 -173.503 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -131.37 160.69 34.31 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 172.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.849 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 21.7 m80 -83.05 170.39 14.9 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.823 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.464 ' HA ' ' SD ' ' A' ' 101' ' ' MET . 1.7 tp -66.96 -29.35 69.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.289 0.566 . . . . 0.0 109.9 174.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -89.24 -11.18 44.35 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.441 177.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.849 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 34.4 m -108.34 0.17 21.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.049 -176.197 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' PHE . . . . . 0.467 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.0 OUTLIER -86.04 59.99 5.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.373 0.606 . . . . 0.0 110.3 178.064 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.9 p -114.22 155.5 26.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.204 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.503 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 17.1 p -68.99 153.62 43.49 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.174 0.512 . . . . 0.0 110.487 177.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.79 7.44 30.44 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.483 -176.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.48 -51.09 2.82 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -176.762 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -115.31 -4.52 12.38 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.508 -177.064 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.441 HH11 ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 66.13 32.04 8.4 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.105 -177.062 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ASN . . . . . 0.426 ' HB3' ' HB3' ' A' ' 137' ' ' CYS . 58.2 t30 -79.45 124.17 28.22 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.347 177.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.432 ' HE ' ' HB3' ' A' ' 121' ' ' ARG . 1.5 ttp180 -78.87 121.82 25.32 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.725 0.298 . . . . 0.0 110.633 -178.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.556 HD13 ' HB2' ' A' ' 128' ' ' PHE . 1.9 mt -69.61 162.0 28.5 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.202 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.411 ' HA ' ' HD3' ' A' ' 124' ' ' PRO . 75.8 t -128.64 130.34 23.5 Favored Pre-proline 0 C--N 1.328 -0.331 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.685 -174.649 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 123' ' ' VAL . 36.3 Cg_exo -61.69 111.28 1.14 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.578 2.185 . . . . 0.0 110.81 174.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.11 -18.66 14.03 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.525 -176.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.471 ' O ' ' HA ' ' A' ' 404' ' ' ILE . 2.0 t70 -112.78 -168.91 1.38 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 177.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.45 ' HA ' ' O ' ' A' ' 208' ' ' SER . 0.0 OUTLIER -90.76 147.14 23.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.473 0.654 . . . . 0.0 112.246 -171.441 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.556 ' HB2' HD13 ' A' ' 122' ' ' LEU . 0.4 OUTLIER -145.33 159.77 42.54 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.711 -1.132 . . . . 0.0 108.566 175.274 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 129' ' ' HIS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 11.2 m-70 -126.62 122.48 35.14 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.104 0.478 . . . . 0.0 111.299 -178.261 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.439 ' CE2' ' HA2' ' A' ' 133' ' ' GLY . 11.0 t80 -124.97 101.27 6.97 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 173.435 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 12.3 mt -124.54 124.18 67.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.464 -176.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 60.9 29.47 19.03 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.864 178.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.439 ' HA2' ' CE2' ' A' ' 130' ' ' TYR . . . 75.18 35.27 49.41 Favored Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.563 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 15.6 m -137.0 146.29 45.15 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.9 mt -98.79 130.4 45.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.346 0.593 . . . . 0.0 111.698 -174.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.503 ' HA ' ' HB2' ' A' ' 115' ' ' CYS . 40.3 m-85 -130.77 163.44 27.31 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.543 172.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' CYS . . . . . 0.678 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 31.0 p -106.54 -173.36 2.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.087 0.47 . . . . 0.0 111.366 -175.509 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.94 -26.43 59.6 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.492 177.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -77.96 -36.43 49.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.591 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.678 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.2 OUTLIER -57.66 -68.32 0.25 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.876 -1.057 . . . . 0.0 111.142 178.035 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 43.16 71.39 1.45 Allowed Pre-proline 0 N--CA 1.465 0.313 0 O-C-N 123.979 0.799 . . . . 0.0 111.389 -177.432 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -49.96 121.73 7.94 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.769 2.313 . . . . 0.0 112.244 -177.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.88 4.12 51.8 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.655 -176.248 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -104.2 -63.51 1.2 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.795 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -111.76 113.72 26.26 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.819 0.342 . . . . 0.0 110.236 178.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.99 157.49 28.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.065 179.625 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -78.52 -18.36 54.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.367 0.604 . . . . 0.0 110.217 177.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 168.98 100.83 0.14 Allowed Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.532 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 202' ' ' GLY . . . . . 0.413 ' HA2' ' OG ' ' A' ' 206' ' ' SER . . . -87.84 53.99 4.3 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.065 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.48 56.9 3.1 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.031 0.443 . . . . 0.0 110.847 -179.156 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 75.11 -78.95 1.05 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.304 -178.565 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -84.2 64.53 4.25 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.231 -0.509 . . . . 0.0 111.97 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 206' ' ' SER . . . . . 0.413 ' OG ' ' HA2' ' A' ' 202' ' ' GLY . 0.4 OUTLIER -84.93 105.77 15.94 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.953 0.406 . . . . 0.0 111.044 -178.292 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 166.8 118.62 0.44 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.08 178.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 208' ' ' SER . . . . . 0.45 ' O ' ' HA ' ' A' ' 127' ' ' ARG . 0.1 OUTLIER -78.7 165.21 23.88 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 177.422 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 404' ' ' ILE . . . . . 0.471 ' HA ' ' O ' ' A' ' 126' ' ' ASP . 51.3 mm -87.31 130.84 36.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 405' ' ' ALA . . . . . 0.446 ' HB2' ' HB3' ' A' ' 128' ' ' PHE . . . -60.56 123.81 75.79 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.92 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 406' ' ' PRO . . . . . 0.467 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 31.6 Cg_exo -60.22 154.72 50.22 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.967 2.445 . . . . 0.0 112.465 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 407' ' ' PHE . . . . . 0.454 ' HA ' ' HD3' ' A' ' 408' ' ' PRO . 21.5 m-85 -87.25 148.24 44.32 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.989 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 408' ' ' PRO . . . . . 0.489 ' HG3' ' SD ' ' A' ' 101' ' ' MET . 9.9 Cg_exo -70.71 138.51 34.94 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.995 2.463 . . . . 0.0 112.089 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -143.14 177.55 8.31 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 177.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -93.53 110.74 22.31 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.861 0.363 . . . . 0.0 110.379 179.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -80.5 -91.9 0.05 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.741 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 14.1 tp -131.08 120.25 18.19 Favored Pre-proline 0 C--N 1.325 -0.458 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 178.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -62.12 121.28 9.25 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.221 1.948 . . . . 0.0 111.259 175.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.762 HG21 ' HB3' ' A' ' 93' ' ' SER . 6.5 m -75.62 153.74 37.09 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.459 -175.76 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 2.1 m 73.59 82.87 0.12 Allowed 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.478 0.711 . . . . 0.0 110.957 177.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.03 137.49 94.04 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.798 179.635 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -80.76 10.36 3.37 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.863 2.375 . . . . 0.0 112.635 177.39 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 418' ' ' LYS . . . . . 0.538 ' HA ' ' HD2' ' A' ' 418' ' ' LYS . 1.2 mmmt . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.197 -0.906 . . . . 0.0 109.795 178.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.718 0 N-CA-C 111.808 -0.517 . . . . 0.0 111.808 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.38 99.02 0.89 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.238 0.542 . . . . 0.0 111.249 178.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -144.89 158.07 43.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.556 177.389 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -69.8 110.96 3.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.096 0.474 . . . . 0.0 110.765 -179.205 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.574 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.3 OUTLIER -102.12 15.76 28.12 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.827 -177.868 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.785 HD13 ' HA ' ' A' ' 83' ' ' ASN . 0.1 OUTLIER -145.75 14.41 1.37 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.922 -178.668 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 49.65 -108.61 0.32 Allowed 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.973 -171.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.21 106.58 2.01 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 172.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.785 ' HA ' HD13 ' A' ' 80' ' ' LEU . 0.8 OUTLIER -47.02 113.96 0.76 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 122.795 0.438 . . . . 0.0 111.778 -176.248 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.11 -73.73 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.566 176.141 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -136.41 127.22 4.07 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.641 -0.79 . . . . 0.0 113.031 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.679 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -149.06 165.25 32.25 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 177.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.33 139.51 39.21 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -20.01 51.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.002 -171.145 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.801 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -77.79 -43.61 30.1 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.981 -0.288 . . . . 0.0 111.461 -174.196 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.422 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 26.9 p -103.21 -64.65 1.06 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.137 0.494 . . . . 0.0 110.36 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.574 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 118.11 45.81 0.48 Allowed Glycine 0 N--CA 1.443 -0.892 0 C-N-CA 120.932 -0.651 . . . . 0.0 111.733 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.42 145.21 48.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.864 0.364 . . . . 0.0 110.261 179.231 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.758 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.0 OUTLIER -67.86 143.03 55.92 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.641 176.766 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.6 mt -111.86 101.84 52.31 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.716 -178.087 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.38 168.45 22.87 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 123.234 2.623 . . . . 0.0 111.519 173.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.49 4.37 4.92 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -175.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -96.67 -17.94 20.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.297 0.57 . . . . 0.0 110.07 177.685 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -102.86 153.31 20.31 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.327 -174.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.552 HD23 ' HB2' ' A' ' 408' ' ' PRO . 1.0 OUTLIER -109.67 143.87 38.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.974 0.416 . . . . 0.0 110.921 -176.672 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 162.19 36.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.785 -179.482 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.49 113.66 23.12 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.972 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -104.68 117.16 33.4 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.647 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -79.27 -59.76 2.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.768 176.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.28 114.25 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.389 176.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.43 -70.14 3.01 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.257 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -89.85 152.73 21.12 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.822 0.344 . . . . 0.0 110.492 -179.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.6 p -119.88 145.5 26.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.345 -177.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -137.99 -175.56 4.14 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.781 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.886 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 26.3 m80 -106.38 -179.72 4.02 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.383 -0.228 . . . . 0.0 110.383 179.349 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.37 -41.96 88.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.132 0.491 . . . . 0.0 110.187 178.745 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.676 ' HE2' ' SG ' ' A' ' 112' ' ' CYS . 0.1 OUTLIER -80.02 -28.35 39.36 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.367 179.134 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.886 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 27.6 m -79.64 -16.32 56.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.182 -178.484 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' PHE . . . . . 0.579 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.0 OUTLIER -76.67 82.15 3.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.251 178.257 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.553 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.0 OUTLIER -136.35 158.24 44.9 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.131 -178.263 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.544 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 3.4 p -72.26 152.19 42.33 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 176.097 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 2.4 m -87.27 5.44 38.3 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -175.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -114.61 -50.63 2.78 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -176.037 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.753 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -115.11 6.99 15.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.809 0.338 . . . . 0.0 110.495 -177.959 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER 52.13 40.18 28.16 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.266 -179.074 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -81.33 130.13 34.91 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.558 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.553 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.6 OUTLIER -76.5 123.21 25.69 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.945 -175.918 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.516 HD13 ' HD2' ' A' ' 128' ' ' PHE . 4.6 mt -80.19 138.21 36.82 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.063 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -134.43 139.89 34.11 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.455 -174.629 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.455 ' HB3' ' CE2' ' A' ' 407' ' ' PHE . 52.8 Cg_exo -54.26 118.95 5.58 Favored 'Trans proline' 0 N--CA 1.463 -0.305 0 C-N-CA 122.575 2.183 . . . . 0.0 111.425 173.417 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 100.27 -0.27 55.89 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.53 -176.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -119.58 -173.35 2.51 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.727 0.299 . . . . 0.0 110.328 177.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -91.88 126.46 36.98 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.984 0.421 . . . . 0.0 111.166 -172.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.516 ' HD2' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -137.08 135.36 37.41 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 174.802 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -124.07 115.98 22.05 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.142 0.496 . . . . 0.0 111.13 -177.087 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.465 ' HB2' ' CZ ' ' A' ' 128' ' ' PHE . 6.2 t80 -103.47 101.41 11.3 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 178.064 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 4.6 mt -118.92 115.28 47.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.622 -176.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 3.3 m120 58.9 31.76 21.61 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.375 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.41 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 80.61 34.36 28.47 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.442 -0.885 . . . . 0.0 112.687 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.493 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 0.4 OUTLIER -139.69 140.17 36.78 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 -179.55 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.3 mt -91.1 122.23 33.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.073 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.544 ' HA ' ' HB2' ' A' ' 115' ' ' CYS . 70.6 m-85 -128.74 158.88 37.37 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.622 176.25 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' CYS . . . . . 0.711 ' SG ' ' HB2' ' A' ' 139' ' ' HIS . 8.5 p -114.08 -168.97 1.43 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.017 0.437 . . . . 0.0 111.35 -177.395 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.25 -22.47 48.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.053 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' HIS . . . . . 0.711 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 37.2 m-70 -78.16 -28.93 48.4 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 120.997 0.427 . . . . 0.0 110.574 -176.662 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.753 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 0.8 OUTLIER -123.02 29.04 6.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.471 -178.6 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.432 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 45.0 ttt180 -51.55 111.19 2.21 Favored Pre-proline 0 N--CA 1.469 0.521 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.706 -178.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 1.0 OUTLIER -84.81 83.08 1.63 Allowed 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 123.366 2.71 . . . . 0.0 112.17 -178.78 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.8 -1.02 4.71 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -178.586 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -67.46 -17.34 64.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.799 0.333 . . . . 0.0 111.385 179.212 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.468 ' HB3' ' H ' ' A' ' 146' ' ' ILE . 3.9 tp -143.21 -102.37 0.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.685 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.468 ' H ' ' HB3' ' A' ' 145' ' ' LEU . 56.4 mt 62.73 101.56 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-O 121.059 0.457 . . . . 0.0 111.292 -175.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -68.36 98.73 0.86 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.205 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 99.17 23.25 11.56 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.849 -0.691 . . . . 0.0 111.81 -177.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -79.37 64.16 3.83 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 121.346 -0.454 . . . . 0.0 112.117 177.531 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.28 87.43 1.48 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.791 0.329 . . . . 0.0 110.849 178.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 69.33 -105.04 1.4 Allowed Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.165 179.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -93.67 -5.12 63.29 Favored Glycine 0 N--CA 1.445 -0.73 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.245 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 14.5 m -62.46 136.39 57.88 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.4 0.619 . . . . 0.0 111.86 -176.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -154.01 -163.16 11.64 Favored Glycine 0 N--CA 1.446 -0.687 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.974 178.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 208' ' ' SER . . . . . 0.477 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 43.9 m -114.83 160.16 19.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.36 0.6 . . . . 0.0 111.311 -179.268 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 5.4 mm -111.57 138.16 41.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.357 178.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 405' ' ' ALA . . . . . 0.439 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -58.8 123.87 70.35 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-O 120.909 0.385 . . . . 0.0 111.532 -178.063 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 406' ' ' PRO . . . . . 0.579 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 31.4 Cg_exo -59.81 161.61 17.98 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.293 2.662 . . . . 0.0 112.491 177.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 407' ' ' PHE . . . . . 0.455 ' CE2' ' HB3' ' A' ' 124' ' ' PRO . 34.1 m-85 -94.77 156.46 38.19 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.481 -177.419 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 408' ' ' PRO . . . . . 0.552 ' HB2' HD23 ' A' ' 99' ' ' LEU . 50.5 Cg_endo -69.3 140.46 44.45 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.895 2.397 . . . . 0.0 112.752 179.302 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -144.82 175.78 9.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.516 178.432 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -98.08 109.74 22.44 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 174.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -85.77 -89.35 0.11 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.447 -175.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.482 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 2.1 tp -131.21 128.88 22.26 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.157 -178.021 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 413' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 3.2 Cg_exo -75.6 155.41 40.19 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.911 2.407 . . . . 0.0 111.913 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.758 HG21 ' HB3' ' A' ' 93' ' ' SER . 0.2 OUTLIER -83.06 176.5 9.18 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.772 177.055 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 415' ' ' SER . . . . . 0.45 ' O ' ' HD3' ' A' ' 417' ' ' PRO . 0.2 OUTLIER -53.5 137.74 35.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.179 177.515 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 14.7 m170 -86.35 110.68 33.37 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.596 -178.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 417' ' ' PRO . . . . . 0.45 ' HD3' ' O ' ' A' ' 415' ' ' SER . 68.0 Cg_endo -90.85 -32.21 0.1 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.73 2.286 . . . . 0.0 113.211 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.246 0.899 0 CA-C-O 118.376 -0.821 . . . . 0.0 111.178 -175.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.619 0 N-CA-C 112.01 -0.436 . . . . 0.0 112.01 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.49 166.13 29.09 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.839 0.352 . . . . 0.0 110.465 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -134.34 107.45 7.63 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.718 0.294 . . . . 0.0 110.595 178.675 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 37.5 mt -118.82 126.92 75.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.341 -179.065 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.451 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.1 OUTLIER -126.49 -32.79 2.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.249 0.547 . . . . 0.0 110.329 177.537 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.754 HD11 ' H ' ' A' ' 84' ' ' SER . 1.5 pt? -98.86 155.31 17.45 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.597 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -73.22 -78.96 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.849 0.356 . . . . 0.0 111.077 -176.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -77.27 96.58 1.24 Allowed Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.473 -0.87 . . . . 0.0 111.17 175.379 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.473 ' HA ' HD11 ' A' ' 80' ' ' LEU . 58.4 t30 -56.41 100.69 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.229 0.537 . . . . 0.0 111.865 -174.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.754 ' H ' HD11 ' A' ' 80' ' ' LEU . 4.4 m -153.99 -62.15 0.13 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.708 175.53 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -141.73 118.56 1.34 Allowed Glycine 0 C--N 1.333 0.399 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.735 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.481 ' HB2' HD13 ' A' ' 80' ' ' LEU . . . -135.78 149.25 49.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.761 0.315 . . . . 0.0 110.424 179.144 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.888 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 3.3 t -57.18 145.93 29.77 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.262 177.275 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.5 m -99.63 -1.38 38.19 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.861 172.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.699 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -102.22 -59.26 1.73 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.014 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 30.7 p -93.98 -31.6 14.19 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 120.265 -0.574 . . . . 0.0 109.862 176.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.888 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 92.83 14.45 55.05 Favored Glycine 0 N--CA 1.45 -0.394 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.953 172.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -89.69 146.84 24.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.722 0.261 . . . . 0.0 110.759 178.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.464 ' HB2' HG21 ' A' ' 414' ' ' THR . 0.0 OUTLIER -66.08 140.31 58.24 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.457 176.984 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.7 mt -110.78 119.34 46.44 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -174.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -78.37 155.53 28.66 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.938 2.425 . . . . 0.0 110.628 167.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.797 ' HB2' ' HG3' ' A' ' 413' ' ' PRO . . . -68.07 -15.23 63.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.972 0.415 . . . . 0.0 111.116 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.94 -5.37 53.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.633 178.168 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -111.43 120.22 41.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.638 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.5 tp -76.1 128.53 35.18 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.968 0.413 . . . . 0.0 110.786 -178.083 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -116.59 140.02 40.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.335 -179.111 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.94 112.6 20.3 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.397 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.449 ' HD3' ' OE2' ' A' ' 409' ' ' GLU . 0.0 OUTLIER -88.42 150.46 23.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.175 -176.118 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -130.58 -134.78 0.21 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.331 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.73 69.75 3.14 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.093 0.473 . . . . 0.0 110.561 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 85.42 -25.79 6.14 Favored Glycine 0 N--CA 1.452 -0.275 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.435 179.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -89.35 156.14 18.9 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.734 0.302 . . . . 0.0 111.044 -177.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.29 132.59 67.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.791 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' TYR . . . . . 0.483 ' HD1' ' HB2' ' A' ' 89' ' ' ALA . 44.8 m-85 -128.15 171.28 12.07 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.332 176.412 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.959 ' H ' ' HB2' ' A' ' 112' ' ' CYS . 23.8 m80 -101.36 179.22 4.42 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 177.159 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.7 mt -62.34 -28.61 69.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.227 0.537 . . . . 0.0 110.698 177.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.512 ' HG3' ' H ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.06 -34.37 15.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.289 176.919 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.959 ' HB2' ' H ' ' A' ' 109' ' ' HIS . 4.2 m -78.78 -5.7 54.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.836 -175.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -96.38 66.0 2.37 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 172.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.576 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.5 OUTLIER -119.97 158.03 27.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.76 -178.95 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.559 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 5.6 t -62.61 152.5 34.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.292 173.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.2 m -87.1 -32.89 19.67 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.799 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -99.12 -51.59 3.79 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -174.006 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.461 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 8.3 p -90.23 -20.33 23.13 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.89 0.376 . . . . 0.0 110.116 178.537 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.559 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 69.52 25.28 5.4 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.844 175.201 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ASN . . . . . 0.461 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 5.1 m-80 -70.1 128.35 35.99 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 174.588 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.576 ' HA ' HG22 ' A' ' 114' ' ' THR . 9.7 ttp85 -65.64 116.99 7.45 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 176.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 19.9 mt -65.5 151.99 45.07 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.731 0.301 . . . . 0.0 110.345 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 90.7 t -123.47 131.31 24.3 Favored Pre-proline 0 C--N 1.325 -0.466 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.651 -171.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.455 ' HA ' ' HB3' ' A' ' 405' ' ' ALA . 27.0 Cg_endo -65.01 110.43 1.5 Allowed 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 121.814 1.676 . . . . 0.0 110.596 172.455 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.52 -17.05 14.15 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.415 -173.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -117.33 -161.18 0.8 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.82 150.34 27.9 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -169.29 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.538 ' O ' ' HB2' ' A' ' 208' ' ' SER . 0.0 OUTLIER -157.62 135.82 11.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.251 172.175 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -126.09 128.59 47.6 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.89 0.376 . . . . 0.0 110.574 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.405 ' HA ' ' O ' ' A' ' 134' ' ' SER . 9.8 t80 -124.81 102.56 7.62 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.836 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.782 HD13 ' HG2' ' A' ' 142' ' ' PRO . 2.6 mp -131.32 130.43 63.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 -179.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.51 32.14 20.42 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 123.463 0.477 . . . . 0.0 110.248 -179.337 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 64.87 36.09 92.68 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.523 -177.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.405 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.9 OUTLIER -131.62 147.85 52.56 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.464 -0.433 . . . . 0.0 109.884 -179.135 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 13.7 mt -101.26 115.06 29.63 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.322 -174.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -122.16 173.32 7.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.67 174.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' CYS . . . . . 0.772 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 29.4 p -119.09 -165.93 1.2 Allowed 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 177.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.09 -25.99 47.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.265 0.555 . . . . 0.0 109.51 175.051 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' HIS . . . . . 0.772 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 68.4 t60 -74.57 -24.34 58.9 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.256 -0.884 . . . . 0.0 108.738 176.726 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.535 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 1.7 m-20 -113.8 23.73 12.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.486 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.431 HH21 ' CB ' ' A' ' 206' ' ' SER . 24.5 ttt-85 -62.88 115.14 15.13 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.125 -175.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.782 ' HG2' HD13 ' A' ' 131' ' ' ILE . 44.9 Cg_exo -56.89 114.87 2.12 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.042 2.494 . . . . 0.0 112.645 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -18.25 56.95 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.762 -179.016 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -99.05 -98.88 0.22 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.251 -175.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.42 75.84 10.2 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.326 -176.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 5.4 tt -97.51 120.89 47.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 175.091 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ASN . . . . . 0.513 ' H ' HG12 ' A' ' 131' ' ' ILE . 5.4 t30 -89.84 74.92 7.35 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.201 0.524 . . . . 0.0 110.394 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 158.74 44.15 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.711 -178.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -84.65 46.69 3.72 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.026 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.67 82.01 1.13 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.008 0.432 . . . . 0.0 110.8 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 73.28 -102.0 1.21 Allowed Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.803 -0.713 . . . . 0.0 111.568 -178.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -75.75 -15.88 81.01 Favored Glycine 0 CA--C 1.518 0.24 0 C-N-CA 121.258 -0.496 . . . . 0.0 112.626 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 206' ' ' SER . . . . . 0.431 ' CB ' HH21 ' A' ' 141' ' ' ARG . 0.7 OUTLIER 59.56 67.17 0.91 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 122.705 0.402 . . . . 0.0 111.379 179.721 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -133.5 130.02 5.55 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.873 -0.679 . . . . 0.0 111.634 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 208' ' ' SER . . . . . 0.538 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -120.66 138.66 53.82 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.947 0.403 . . . . 0.0 111.431 -178.849 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 35.5 mm -101.06 142.16 16.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.836 178.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 405' ' ' ALA . . . . . 0.455 ' HB3' ' HA ' ' A' ' 124' ' ' PRO . . . -52.9 136.52 46.48 Favored Pre-proline 0 C--O 1.233 0.218 0 CA-C-O 120.757 0.313 . . . . 0.0 111.209 177.588 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 406' ' ' PRO . . . . . 0.5 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 11.7 Cg_exo -72.17 2.17 5.24 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.521 2.814 . . . . 0.0 113.335 -174.537 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 407' ' ' PHE . . . . . 0.5 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 10.0 m-85 73.89 156.95 0.16 Allowed Pre-proline 0 N--CA 1.469 0.505 0 O-C-N 123.673 0.608 . . . . 0.0 111.395 178.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -83.71 136.02 7.1 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.882 2.388 . . . . 0.0 112.05 177.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 409' ' ' GLU . . . . . 0.449 ' OE2' ' HD3' ' A' ' 102' ' ' ARG . 1.0 OUTLIER -137.87 177.82 7.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.162 179.358 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -97.31 126.55 42.6 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.786 0.327 . . . . 0.0 110.626 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -94.84 -168.25 1.78 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.377 178.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.443 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.4 OUTLIER -71.86 128.62 89.22 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.394 179.708 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 413' ' ' PRO . . . . . 0.797 ' HG3' ' HB2' ' A' ' 96' ' ' ALA . 10.0 Cg_exo -72.2 130.42 16.4 Favored 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 122.959 2.439 . . . . 0.0 112.626 -175.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.475 ' HA ' ' HB2' ' A' ' 84' ' ' SER . 0.4 OUTLIER -79.29 161.18 26.45 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.1 178.122 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.88 157.1 22.36 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -92.04 152.87 43.17 Favored Pre-proline 0 C--O 1.233 0.221 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.073 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -78.89 178.35 7.64 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.647 2.232 . . . . 0.0 112.154 176.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 1.3 mmtm . . . . . 0 C--O 1.245 0.848 0 CA-C-O 118.455 -0.783 . . . . 0.0 110.601 -178.652 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.591 0 N-CA-C 111.77 -0.532 . . . . 0.0 111.77 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.36 -45.3 2.93 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.814 0.34 . . . . 0.0 110.332 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 1.9 t80 57.93 43.91 20.61 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.092 179.671 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -112.19 127.88 69.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.907 0.384 . . . . 0.0 110.789 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -145.47 22.38 1.49 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.36 178.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.677 ' HB2' ' HA ' ' A' ' 83' ' ' ASN . 0.8 OUTLIER -140.46 131.14 25.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.757 -177.867 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -81.1 104.41 11.57 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 176.606 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.43 5.43 86.99 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.468 -0.873 . . . . 0.0 111.892 -177.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.677 ' HA ' ' HB2' ' A' ' 80' ' ' LEU . 23.5 t-20 59.7 55.6 3.92 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.133 0.492 . . . . 0.0 111.434 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.41 ' HB2' ' N ' ' A' ' 415' ' ' SER . 29.1 m -157.96 107.4 2.09 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.415 175.507 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.36 133.29 1.79 Allowed Glycine 0 CA--C 1.519 0.328 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.824 178.19 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.43 ' HA ' ' HA ' ' A' ' 93' ' ' SER . . . -167.4 150.71 6.28 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 177.075 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.93 145.96 30.61 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.15 -10.76 59.06 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.08 -170.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.812 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -85.14 -46.91 10.66 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.164 -176.114 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.553 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 30.5 p -102.95 -77.35 0.56 Allowed 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.873 -178.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.553 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 147.33 -1.12 0.72 Allowed Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.742 -177.073 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -83.21 146.02 28.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.895 0.379 . . . . 0.0 110.181 177.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.43 ' HA ' ' HA ' ' A' ' 86' ' ' ALA . 1.2 m -76.48 169.09 18.91 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.159 176.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.7 mt -111.25 104.74 56.52 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-O 120.744 0.307 . . . . 0.0 111.244 -176.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.912 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 2.9 Cg_exo -76.29 167.75 25.22 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.853 2.369 . . . . 0.0 111.012 173.039 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.24 -9.01 51.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.06 0.457 . . . . 0.0 111.195 -178.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.31 -10.77 34.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.876 178.332 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.912 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 3.3 mm-40 -101.81 163.13 12.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.506 -179.333 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.559 ' HB2' HD12 ' A' ' 110' ' ' LEU . 10.3 mt -132.66 133.75 43.97 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.524 -178.335 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.406 HG12 ' HA ' ' A' ' 109' ' ' HIS . 2.0 m -118.21 148.97 20.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.828 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.64 121.97 37.91 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 175.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.406 ' HA ' HG12 ' A' ' 107' ' ' VAL . 14.4 ttt85 -88.52 129.21 35.52 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.47 -175.301 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -112.22 -147.93 0.42 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.59 77.79 2.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.934 0.397 . . . . 0.0 110.736 178.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.5 -42.39 2.7 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.857 -0.611 . . . . 0.0 112.603 176.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -89.7 156.24 18.68 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.838 0.351 . . . . 0.0 110.797 -178.198 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.406 HG12 ' HA ' ' A' ' 102' ' ' ARG . 0.4 OUTLIER -127.95 148.87 32.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.592 179.688 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -136.63 149.92 48.25 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 178.096 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.896 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 33.9 m80 -71.35 171.35 11.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.902 0.382 . . . . 0.0 110.798 -177.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.559 HD12 ' HB2' ' A' ' 99' ' ' LEU . 0.3 OUTLIER -61.26 -26.19 67.59 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.101 0.477 . . . . 0.0 111.171 175.971 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.417 ' HG2' ' H ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.82 -20.64 22.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.881 177.478 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.896 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 7.5 m -100.31 -18.65 16.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.184 -170.184 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -67.6 83.57 0.18 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.086 0.47 . . . . 0.0 110.201 176.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.574 HG22 ' HA ' ' A' ' 121' ' ' ARG . 2.5 p -135.67 160.63 37.91 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.528 -174.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.532 ' HB3' ' H ' ' A' ' 120' ' ' ASN . 37.2 t -60.88 154.18 22.86 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.626 177.455 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 1.2 m -95.64 -10.39 29.53 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.092 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -107.94 -52.48 2.76 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.839 -0.345 . . . . 0.0 111.815 -179.444 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.414 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -98.97 -20.09 16.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.11 0.481 . . . . 0.0 109.96 179.124 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.517 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.1 OUTLIER 64.94 37.54 6.91 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.891 -178.288 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ASN . . . . . 0.55 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 72.8 m-20 -75.53 140.95 43.05 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 174.394 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.574 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.1 OUTLIER -77.6 112.41 14.37 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 176.492 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.547 HD13 ' HB2' ' A' ' 128' ' ' PHE . 10.0 mt -70.7 152.46 43.81 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.362 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 8.9 t -119.09 135.04 23.65 Favored Pre-proline 0 C--N 1.325 -0.468 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.955 -168.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -56.99 111.59 0.85 Allowed 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 122.581 2.187 . . . . 0.0 111.207 174.264 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.59 5.9 56.6 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.513 -178.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -126.05 -173.95 2.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.757 0.313 . . . . 0.0 111.043 177.197 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.457 ' HA ' ' O ' ' A' ' 208' ' ' SER . 6.9 mmt-85 -73.86 136.64 43.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.383 0.611 . . . . 0.0 112.294 -171.131 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.547 ' HB2' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -148.84 153.28 37.86 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.966 -1.015 . . . . 0.0 108.578 175.517 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -135.45 133.62 38.76 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.492 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.406 ' HA ' ' O ' ' A' ' 134' ' ' SER . 5.1 t80 -126.17 102.11 7.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.378 175.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.47 HD12 ' HD2' ' A' ' 136' ' ' PHE . 2.8 mp -127.68 128.04 69.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 -178.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.5 m120 61.02 32.56 19.86 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.579 0.549 . . . . 0.0 111.016 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 68.07 35.27 83.4 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.436 -0.888 . . . . 0.0 112.037 -178.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.406 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.7 OUTLIER -138.41 146.91 42.77 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -178.253 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 9.6 mt -99.34 129.12 45.52 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.899 0.38 . . . . 0.0 110.617 -176.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.47 ' HD2' HD12 ' A' ' 131' ' ' ILE . 69.2 m-85 -129.44 161.24 30.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.501 179.4 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' CYS . . . . . 0.55 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 6.1 m -93.31 176.1 6.52 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.059 0.456 . . . . 0.0 109.831 175.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.95 -14.22 59.61 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 162.247 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' HIS . . . . . 0.46 ' HB3' ' HB2' ' A' ' 137' ' ' CYS . 67.8 t60 -70.11 -46.83 63.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.129 -1.396 . . . . 0.0 110.517 177.221 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.414 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 1.9 p-10 -109.83 13.52 23.54 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.281 -177.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.521 ' HE ' ' HB2' ' A' ' 206' ' ' SER . 22.2 ttt-85 -47.55 114.4 3.1 Favored Pre-proline 0 N--CA 1.468 0.445 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.998 -177.201 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 6.0 Cg_exo -79.85 118.92 3.86 Favored 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 123.286 2.657 . . . . 0.0 112.262 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -11.21 60.66 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -99.24 -18.61 17.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.949 0.404 . . . . 0.0 111.355 -179.511 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 1.2 mt -127.79 83.4 2.16 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.009 0.433 . . . . 0.0 110.31 -178.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -139.5 139.94 37.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.035 -179.105 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -100.39 78.0 1.99 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.081 0.467 . . . . 0.0 110.18 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 100.16 173.16 30.05 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.107 -178.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 202' ' ' GLY . . . . . 0.451 ' HA3' ' OG ' ' A' ' 206' ' ' SER . . . 123.18 148.22 7.54 Favored Glycine 0 N--CA 1.442 -0.909 0 C-N-CA 120.782 -0.723 . . . . 0.0 111.898 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 2.6 m -112.68 35.96 3.64 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.22 0.533 . . . . 0.0 110.797 -178.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 123.71 -62.01 0.57 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.775 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -75.97 -44.69 18.29 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.254 178.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 206' ' ' SER . . . . . 0.521 ' HB2' ' HE ' ' A' ' 141' ' ' ARG . 7.8 m 50.82 65.02 1.59 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 122.462 0.305 . . . . 0.0 111.172 -178.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -110.34 85.49 0.4 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.588 -178.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 208' ' ' SER . . . . . 0.457 ' O ' ' HA ' ' A' ' 127' ' ' ARG . 0.0 OUTLIER -73.09 148.58 43.86 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.862 0.363 . . . . 0.0 110.599 178.731 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 48.3 mm -104.42 136.89 35.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.348 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -60.82 126.11 84.67 Favored Pre-proline 0 C--N 1.33 -0.261 0 O-C-N 123.42 0.45 . . . . 0.0 109.955 176.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 406' ' ' PRO . . . . . 0.552 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 82.9 Cg_exo -44.05 -71.06 0.06 OUTLIER 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.722 2.948 . . . . 0.0 113.133 -173.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 407' ' ' PHE . . . . . 0.552 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 0.2 OUTLIER 149.92 157.93 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.691 0 C-N-CA 125.185 1.394 . . . . 0.0 108.739 177.558 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 408' ' ' PRO . . . . . 0.532 ' HD2' ' CD2' ' A' ' 407' ' ' PHE . 39.7 Cg_exo -61.42 132.29 40.23 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.692 2.261 . . . . 0.0 112.05 174.258 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -138.4 154.38 48.91 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.956 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -86.73 130.84 34.32 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 176.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -107.38 -120.3 0.25 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.258 -177.334 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.426 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.2 OUTLIER -96.38 129.13 34.23 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.156 -179.217 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 413' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 20.7 Cg_exo -66.17 151.23 84.13 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 123.213 2.609 . . . . 0.0 112.771 -177.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 26.5 m -68.32 141.96 55.65 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.815 177.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 415' ' ' SER . . . . . 0.41 ' N ' ' HB2' ' A' ' 84' ' ' SER . 12.6 p 62.59 179.08 0.14 Allowed 'General case' 0 N--CA 1.467 0.376 0 O-C-N 124.094 0.871 . . . . 0.0 111.704 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -112.13 91.63 16.4 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 172.233 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -81.47 8.95 4.1 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.036 2.491 . . . . 0.0 112.429 -176.214 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.635 -0.698 . . . . 0.0 110.498 -178.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.746 0 N-CA-C 111.997 -0.441 . . . . 0.0 111.997 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.59 66.69 2.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.976 0.417 . . . . 0.0 111.462 -178.393 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -118.22 149.37 41.21 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 177.408 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -98.88 127.53 51.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.993 0.901 . . . . 0.0 112.558 -169.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.7 ttp180 -138.7 12.38 2.71 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.535 -1.211 . . . . 0.0 108.018 169.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.639 ' HB3' ' HA ' ' A' ' 83' ' ' ASN . 2.6 mm? -105.77 117.53 34.26 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 114.582 -1.19 . . . . 0.0 110.681 -173.056 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -70.36 -48.5 56.04 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.706 178.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -102.87 -12.8 31.19 Favored Glycine 0 N--CA 1.454 -0.155 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.203 178.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.639 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 1.4 t30 67.77 37.36 3.23 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.083 0.468 . . . . 0.0 111.243 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -116.16 -69.84 0.83 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.801 179.233 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLY . . . . . 0.459 ' O ' ' HA ' ' A' ' 93' ' ' SER . . . -133.64 143.42 15.1 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.983 -0.627 . . . . 0.0 111.999 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -147.88 170.77 16.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.708 0.254 . . . . 0.0 110.679 -177.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.665 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 50.4 t -75.01 145.77 42.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.567 179.144 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.7 m -80.93 -9.6 59.81 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.372 176.794 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -113.75 -58.01 2.21 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.802 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 37.7 m -71.19 -43.04 68.2 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.481 0.658 . . . . 0.0 109.972 178.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.665 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 87.2 0.28 85.21 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.586 -176.625 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.03 132.37 38.91 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.459 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 0.0 OUTLIER -57.89 123.38 15.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 175.917 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.453 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 8.0 mt -79.24 117.13 65.27 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.26 -176.294 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.538 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 2.7 Cg_exo -77.66 158.89 31.97 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 123.098 2.532 . . . . 0.0 111.271 174.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.713 ' HB2' ' HB3' ' A' ' 413' ' ' PRO . . . -66.37 -21.76 66.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.226 0.536 . . . . 0.0 111.001 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.96 2.39 30.95 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.509 -179.318 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.538 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -107.88 159.32 16.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.075 0.464 . . . . 0.0 110.904 -178.732 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.2 mt -121.42 124.66 45.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.574 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.551 ' HB ' ' O ' ' A' ' 108' ' ' TYR . 19.2 m -123.44 169.51 14.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.135 -173.761 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -115.77 112.26 21.75 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.22 0.533 . . . . 0.0 109.943 178.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.71 98.06 10.18 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.261 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -74.64 -45.37 45.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.504 178.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.434 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -161.53 -129.18 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -179.988 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.434 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -66.24 -22.37 70.88 Favored Glycine 0 N--CA 1.451 -0.326 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 173.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -89.15 135.37 33.6 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 2.5 p -123.12 128.24 74.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.442 -177.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' TYR . . . . . 0.551 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 38.7 m-85 -125.49 176.61 6.71 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.147 -179.346 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.79 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 70.4 m80 -99.42 -149.58 0.36 Allowed 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 175.762 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.425 ' H ' ' HG ' ' A' ' 110' ' ' LEU . 0.0 OUTLIER -86.87 -30.12 21.66 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.146 174.4 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.432 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.8 -34.02 16.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.797 0.332 . . . . 0.0 111.863 -172.239 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.79 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.1 OUTLIER -75.74 -19.4 59.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.261 0.553 . . . . 0.0 110.498 -176.402 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -76.41 72.31 3.13 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.412 176.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.635 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.1 p -137.79 157.95 45.37 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.453 -178.286 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.452 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 11.4 p -79.02 154.25 29.62 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 120.867 0.365 . . . . 0.0 110.247 176.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -53.78 18.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -174.128 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.6 -50.8 14.43 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -168.164 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.31 -13.58 19.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.595 0.236 . . . . 0.0 111.422 -175.249 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.452 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.9 OUTLIER 63.33 42.98 6.44 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.658 -179.389 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -77.99 122.7 25.88 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.408 176.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.635 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.0 OUTLIER -73.25 122.68 22.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.733 0.301 . . . . 0.0 110.683 179.802 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.491 HD22 ' HB2' ' A' ' 128' ' ' PHE . 8.9 mt -71.83 143.08 49.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 176.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.3 t -139.17 138.36 20.73 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-O 121.031 0.443 . . . . 0.0 111.568 -166.171 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.3 110.98 1.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.576 2.184 . . . . 0.0 110.865 175.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 120.77 -15.86 9.61 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 -175.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -113.72 -159.44 0.69 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 127' ' ' ARG . 0.0 OUTLIER -118.99 129.36 55.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.158 0.504 . . . . 0.0 111.444 -175.754 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.491 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.6 OUTLIER -117.53 138.64 51.76 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 172.538 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -104.88 108.98 20.76 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.93 0.395 . . . . 0.0 111.068 -177.126 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -95.77 100.86 12.52 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 174.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.435 ' HA ' ' OD1' ' A' ' 147' ' ' ASN . 57.1 mt -122.95 122.88 66.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.089 -175.733 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.4 t30 58.85 28.77 17.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.599 -176.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 73.38 32.66 59.68 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.34 -178.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 3.9 m -132.57 155.92 47.8 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 -177.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 67.3 mt -95.72 116.62 29.14 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 123.242 0.339 . . . . 0.0 110.821 -176.454 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -125.79 150.83 47.47 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.916 177.089 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' CYS . . . . . 0.563 ' SG ' ' HB2' ' A' ' 139' ' ' HIS . 17.8 p -99.47 -172.39 2.25 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.357 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -77.56 -20.83 53.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.873 0.368 . . . . 0.0 110.744 177.22 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' HIS . . . . . 0.563 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 1.0 OUTLIER -81.81 -38.82 24.95 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 178.252 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.484 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 2.0 m-20 -74.74 -31.24 61.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.586 178.697 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -20.79 101.88 0.07 OUTLIER Pre-proline 0 N--CA 1.47 0.538 0 O-C-N 125.294 1.621 . . . . 0.0 114.103 -177.033 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -70.74 162.61 41.98 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 122.901 2.401 . . . . 0.0 112.322 176.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 98.4 m -110.12 150.4 28.65 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.89 176.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . 73.94 -62.04 0.48 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.399 0.679 . . . . 0.0 111.607 178.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.62 62.29 7.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.094 0.473 . . . . 0.0 110.206 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.516 ' H ' HG13 ' A' ' 146' ' ' ILE . 0.0 OUTLIER -117.54 78.37 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.311 178.173 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 147' ' ' ASN . . . . . 0.435 ' OD1' ' HA ' ' A' ' 131' ' ' ILE . 0.8 OUTLIER -70.09 -17.42 63.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.608 -176.986 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -114.61 24.25 11.32 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.927 178.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -134.75 123.99 3.32 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.085 -178.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.83 82.38 7.52 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 174.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 78.39 -59.02 4.06 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 -176.139 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -134.99 -114.82 1.45 Allowed Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 111.126 -0.79 . . . . 0.0 111.126 175.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -82.5 99.4 9.46 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.045 0.45 . . . . 0.0 111.067 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -126.48 28.09 4.83 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.915 -0.659 . . . . 0.0 111.868 179.038 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.09 162.74 34.21 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 -177.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 404' ' ' ILE . . . . . 0.426 ' O ' ' HD1' ' A' ' 128' ' ' PHE . 15.4 mm -125.05 -94.03 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 O-C-N 123.292 0.37 . . . . 0.0 110.067 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 405' ' ' ALA . . . . . 0.439 ' HA ' ' CD1' ' A' ' 128' ' ' PHE . . . -169.9 157.34 6.25 Favored Pre-proline 0 C--O 1.234 0.244 0 N-CA-C 110.41 -0.219 . . . . 0.0 110.41 -177.224 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 406' ' ' PRO . . . . . 0.496 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 73.6 Cg_endo -77.76 -19.3 12.78 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.293 1.995 . . . . 0.0 111.318 174.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 407' ' ' PHE . . . . . 0.496 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 4.4 m-85 76.17 149.93 0.13 Allowed Pre-proline 0 CA--C 1.533 0.312 0 O-C-N 124.419 1.074 . . . . 0.0 111.381 177.626 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.38 116.54 4.35 Favored 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.564 2.176 . . . . 0.0 112.646 178.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -136.8 177.31 7.96 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.927 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -89.58 134.33 34.18 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.144 -179.069 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -107.21 -166.38 1.15 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.429 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 2.4 mp -67.64 122.49 83.65 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.321 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 413' ' ' PRO . . . . . 0.713 ' HB3' ' HB2' ' A' ' 96' ' ' ALA . 7.0 Cg_exo -72.92 135.85 24.05 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 123.088 2.525 . . . . 0.0 113.04 -175.013 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -67.08 153.39 43.78 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.601 176.06 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.1 m -64.72 167.72 7.03 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 416' ' ' HIS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 417' ' ' PRO . 94.1 m-70 -69.18 139.9 90.33 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.878 -179.4 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 417' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 416' ' ' HIS . 62.0 Cg_endo -91.69 -165.2 0.15 Allowed 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 123.429 2.753 . . . . 0.0 112.853 -178.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.773 -0.632 . . . . 0.0 110.024 177.219 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.828 0 N-CA-C 111.849 -0.501 . . . . 0.0 111.849 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.14 88.95 2.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.018 0.437 . . . . 0.0 111.047 -179.138 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -118.07 -1.28 11.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.148 0.499 . . . . 0.0 110.86 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -81.31 65.01 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.407 0.623 . . . . 0.0 111.53 -175.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.26 -9.24 22.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.085 177.079 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.631 ' HG ' ' HB2' ' A' ' 86' ' ' ALA . 5.1 mp -99.53 14.42 29.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.72 -173.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.561 ' HB2' ' OG ' ' A' ' 93' ' ' SER . 0.2 OUTLIER 47.58 56.25 7.31 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 123.624 0.578 . . . . 0.0 112.184 176.322 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.33 5.2 59.34 Favored Glycine 0 C--N 1.327 0.046 0 C-N-CA 120.429 -0.891 . . . . 0.0 111.981 -178.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.467 ' HA ' ' CB ' ' A' ' 80' ' ' LEU . 61.3 t30 69.24 65.49 0.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 123.68 0.792 . . . . 0.0 112.285 175.681 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.526 ' CB ' ' HA ' ' A' ' 414' ' ' THR . 0.1 OUTLIER -106.36 -55.28 2.35 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.981 173.382 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -162.95 167.36 37.3 Favored Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.631 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . . . -153.31 135.16 14.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.71 0.29 . . . . 0.0 110.661 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.445 ' HB2' ' CE1' ' A' ' 109' ' ' HIS . 19.0 t -67.4 145.43 55.04 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.336 175.471 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.7 m -79.11 -0.14 30.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.356 178.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.531 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -124.95 -55.78 1.58 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.68 -0.236 . . . . 0.0 111.188 176.528 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 25.4 m -76.37 -26.67 55.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.786 0.327 . . . . 0.0 111.137 -178.367 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.25 32.68 84.59 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.287 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.413 ' O ' ' HA ' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -119.63 162.5 18.87 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.631 0.253 . . . . 0.0 110.406 179.831 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.561 ' OG ' ' HB2' ' A' ' 81' ' ' PHE . 0.7 OUTLIER -78.64 171.09 15.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.998 -178.684 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.705 HG12 HG11 ' A' ' 100' ' ' VAL . 2.3 mp -127.44 119.68 21.84 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.058 -175.326 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.666 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 7.8 Cg_exo -74.11 167.53 26.96 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.817 2.345 . . . . 0.0 111.12 171.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.4 -12.4 61.39 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.086 0.469 . . . . 0.0 111.183 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.98 -14.03 34.88 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.168 -179.007 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.666 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -94.92 102.7 14.55 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.032 0.444 . . . . 0.0 110.966 -174.445 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.418 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 62.5 mt -71.66 126.59 30.1 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 173.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.705 HG11 HG12 ' A' ' 94' ' ' ILE . 13.8 m -122.25 149.11 25.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.094 -174.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.28 153.75 21.76 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.66 155.46 49.67 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.701 -178.054 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -124.38 -113.4 0.3 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.019 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -92.68 75.46 5.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.111 0.481 . . . . 0.0 110.688 -178.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.82 -39.12 3.09 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.748 178.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -89.74 167.22 13.05 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.671 0.272 . . . . 0.0 110.92 -178.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 2.5 m -124.0 160.99 27.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 121.356 0.598 . . . . 0.0 112.588 -173.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' TYR . . . . . 0.651 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 73.7 m-85 -139.32 -170.26 2.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.654 -1.157 . . . . 0.0 107.977 173.769 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.831 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 71.7 m80 -112.29 -155.06 0.56 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 173.565 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -84.36 -25.31 29.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.139 0.495 . . . . 0.0 110.875 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.21 -32.84 16.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.084 -175.069 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.831 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -84.63 -16.34 42.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.655 -172.241 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -78.25 65.09 3.52 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.457 0.646 . . . . 0.0 110.624 179.239 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.673 HG22 ' HA ' ' A' ' 121' ' ' ARG . 12.1 p -121.35 164.52 16.93 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.892 -178.193 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.746 ' HB3' ' H ' ' A' ' 120' ' ' ASN . 41.3 t -60.24 152.74 24.02 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.203 172.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.97 -14.77 20.42 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.719 178.675 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.98 -50.94 4.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.594 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.56 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -106.63 -11.26 15.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.189 -178.35 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.621 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 61.61 36.2 16.85 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.592 -178.041 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ASN . . . . . 0.746 ' H ' ' HB3' ' A' ' 115' ' ' CYS . 0.8 OUTLIER -80.44 130.46 35.17 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 176.712 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.673 ' HA ' HG22 ' A' ' 114' ' ' THR . 1.6 ttp85 -76.29 117.83 18.37 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.887 0.375 . . . . 0.0 110.602 -177.515 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.4 mt -66.39 150.81 48.34 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.757 -177.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 11.7 t -131.77 140.95 39.86 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.066 -171.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -56.21 111.03 0.66 Allowed 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.375 2.05 . . . . 0.0 111.074 172.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.33 -19.58 13.04 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 -174.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -100.76 167.5 10.27 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 2.2 mtm-85 -106.52 145.89 31.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.02 0.438 . . . . 0.0 111.776 -173.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -129.11 149.24 51.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.861 174.6 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' HIS . . . . . 0.547 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 87.8 m-70 -117.06 109.26 16.75 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.535 -177.759 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.48 ' HA ' ' O ' ' A' ' 134' ' ' SER . 1.6 t80 -92.7 102.22 14.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.066 0.46 . . . . 0.0 109.846 178.397 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 12.0 mt -123.13 122.66 66.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.874 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 62.3 26.47 15.83 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.665 0.603 . . . . 0.0 111.086 178.131 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 78.28 34.19 37.51 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.229 -179.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.48 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.4 OUTLIER -139.0 152.73 47.88 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -177.859 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.3 mt -102.39 114.08 27.96 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.481 -174.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.547 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 64.9 m-85 -109.44 150.51 27.99 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 174.298 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' CYS . . . . . 0.473 ' HB3' ' HB2' ' A' ' 115' ' ' CYS . 11.4 p -114.47 176.13 5.18 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.393 -176.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -68.22 -17.53 64.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.308 -175.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' HIS . . . . . 0.405 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 26.7 t60 -75.18 -45.94 37.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.114 -176.548 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.56 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 10.2 p-10 -93.17 -39.48 11.0 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.069 -177.646 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 24.24 84.86 0.12 Allowed Pre-proline 0 N--CA 1.477 0.911 0 O-C-N 124.507 1.13 . . . . 0.0 113.761 176.209 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.38 134.29 63.38 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.767 2.311 . . . . 0.0 112.879 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.6 m -104.7 -25.71 12.58 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.102 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -68.63 -50.78 48.69 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.899 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.08 102.09 5.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.63 178.184 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 2.3 tt -135.78 138.33 47.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.982 178.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -83.11 -18.63 38.87 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.068 0.461 . . . . 0.0 111.042 -178.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -139.48 -126.17 2.32 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 178.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 84.39 -36.67 2.92 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.815 -0.707 . . . . 0.0 113.282 174.556 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -79.74 -80.02 0.13 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.991 0.424 . . . . 0.0 111.269 -178.67 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . -84.24 103.52 2.61 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.208 -176.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 89.38 0.22 80.08 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.964 -0.636 . . . . 0.0 111.726 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 206' ' ' SER . . . . . 0.427 ' HB2' ' H ' ' A' ' 207' ' ' GLY . 0.7 OUTLIER 54.54 -107.34 0.37 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.09 0.556 . . . . 0.0 111.583 -177.464 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 207' ' ' GLY . . . . . 0.427 ' H ' ' HB2' ' A' ' 206' ' ' SER . . . -134.36 170.3 22.7 Favored Glycine 0 N--CA 1.448 -0.54 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 -178.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.22 140.92 38.91 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.036 0.446 . . . . 0.0 111.274 -175.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 26.7 mm -71.55 146.89 11.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 172.562 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 405' ' ' ALA . . . . . 0.433 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -48.28 117.53 5.85 Favored Pre-proline 0 C--N 1.33 -0.26 0 O-C-N 123.313 0.383 . . . . 0.0 110.509 176.777 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 406' ' ' PRO . . . . . 0.459 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 14.6 Cg_exo -69.85 8.13 0.86 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.748 2.965 . . . . 0.0 113.732 -172.379 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 407' ' ' PHE . . . . . 0.459 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 33.2 m-85 71.07 159.71 0.16 Allowed Pre-proline 0 C--O 1.234 0.252 0 O-C-N 123.76 0.663 . . . . 0.0 111.248 178.746 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 408' ' ' PRO . . . . . 0.418 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 2.9 Cg_exo -76.28 132.05 13.4 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.791 2.327 . . . . 0.0 111.787 175.27 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.32 177.25 7.83 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.823 178.894 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -85.89 142.27 28.98 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.271 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 411' ' ' ALA . . . . . 0.485 ' HB2' HG21 ' A' ' 100' ' ' VAL . . . -103.4 -134.15 0.32 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.778 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.467 HD13 ' HA ' ' A' ' 412' ' ' LEU . 1.1 mm? -100.17 124.99 41.29 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 178.414 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 413' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 34.2 Cg_exo -58.79 150.67 69.59 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 123.077 2.518 . . . . 0.0 112.705 179.223 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.526 ' HA ' ' CB ' ' A' ' 84' ' ' SER . 0.3 OUTLIER -67.67 149.78 49.57 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.297 -178.261 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.1 m -54.01 113.82 1.37 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.362 0.601 . . . . 0.0 112.134 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -76.05 154.23 84.66 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.627 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -81.99 2.29 8.64 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.827 2.352 . . . . 0.0 112.997 178.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.86 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.302 -179.265 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.555 0 N-CA-C 111.901 -0.48 . . . . 0.0 111.901 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.76 -61.86 1.51 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.683 0.277 . . . . 0.0 111.461 -177.424 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -100.57 49.93 0.89 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.784 0.291 . . . . 0.0 111.784 -172.626 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.513 ' H ' HG13 ' A' ' 78' ' ' ILE . 0.0 OUTLIER -88.88 66.29 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.818 0.342 . . . . 0.0 110.731 179.403 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.715 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER -145.97 13.77 1.31 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.611 -177.697 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.71 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.4 OUTLIER -126.79 169.13 13.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.71 0.29 . . . . 0.0 110.982 -176.538 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 -88.34 114.23 24.75 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.214 -178.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.482 ' HA3' ' CB ' ' A' ' 415' ' ' SER . . . 102.54 -33.92 6.15 Favored Glycine 0 C--N 1.33 0.247 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 -177.113 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASN . . . . . 0.445 HD21 HG23 ' A' ' 78' ' ' ILE . 2.3 t30 67.22 83.82 0.16 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 172.747 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.656 ' H ' HD11 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -139.68 -43.06 0.44 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.153 173.446 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLY . . . . . 0.471 ' O ' HG21 ' A' ' 414' ' ' THR . . . -167.76 140.33 6.18 Favored Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 111.114 -0.794 . . . . 0.0 111.114 178.141 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.71 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -141.18 164.91 28.98 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 117.005 0.403 . . . . 0.0 111.488 -174.342 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.704 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 37.7 t -65.41 144.49 57.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.357 176.62 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.82 -15.97 61.62 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.007 178.685 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.439 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -111.21 -59.35 1.98 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.636 -0.257 . . . . 0.0 111.257 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 10.5 m -74.32 -43.61 56.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.35 0.595 . . . . 0.0 110.729 -179.297 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.715 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 81.62 12.58 81.49 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.962 -176.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -75.99 148.29 38.19 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.867 0.365 . . . . 0.0 110.854 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.508 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -69.55 129.27 39.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.9 176.147 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.5 mt -94.05 108.75 37.65 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-O 120.963 0.411 . . . . 0.0 111.048 -178.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.687 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 9.5 Cg_exo -72.76 167.19 27.87 Favored 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.772 2.314 . . . . 0.0 111.673 175.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.627 ' HB2' ' HB3' ' A' ' 413' ' ' PRO . . . -74.96 -3.76 34.18 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.995 0.426 . . . . 0.0 111.383 -179.211 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.31 -4.03 30.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.654 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.687 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.3 OUTLIER -94.11 123.4 37.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.304 -174.462 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.6 mt -89.45 114.7 26.22 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 173.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -115.82 141.9 31.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.275 -171.194 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.507 ' HA ' ' HA ' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -82.61 111.39 18.54 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.632 -177.623 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.461 ' H ' ' HG3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -111.52 127.4 55.7 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.104 -176.538 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.4 ' HA ' ' HG3' ' A' ' 406' ' ' PRO . . . -72.56 -39.15 67.68 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.067 0.461 . . . . 0.0 110.083 176.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.516 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 1.8 tp-100 -171.73 -100.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.656 -179.111 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.516 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -83.97 -17.98 64.16 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.934 -0.65 . . . . 0.0 111.724 177.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -101.99 149.4 24.27 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 9.7 p -122.7 148.45 26.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.221 -173.354 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -139.69 -170.25 2.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.656 177.08 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.761 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 69.1 m80 -114.17 -161.59 0.77 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 173.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.3 mp -85.35 -19.43 31.46 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.235 0.541 . . . . 0.0 111.037 179.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.498 ' HA ' ' NH1' ' A' ' 121' ' ' ARG . 0.0 OUTLIER -90.16 -38.41 13.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.436 -176.105 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.761 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.56 -28.29 56.21 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.366 -174.182 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.45 82.23 0.79 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.038 -179.429 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.9 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.1 p -143.97 161.05 39.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.199 -176.319 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.565 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 1.7 t -67.62 142.23 56.5 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 173.59 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.98 -11.88 51.87 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.869 0.366 . . . . 0.0 111.091 -177.592 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.489 ' HB ' ' OD2' ' A' ' 140' ' ' ASP . 0.2 OUTLIER -91.62 -51.01 5.46 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -174.813 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.618 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 22.2 p -115.83 -7.42 12.05 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.886 0.374 . . . . 0.0 110.73 -178.245 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.565 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 70.99 27.4 3.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.981 -177.065 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ASN . . . . . 0.618 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 3.7 t-20 -54.2 119.24 4.85 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.241 172.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.9 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.0 OUTLIER -69.39 108.24 3.65 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 177.277 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.713 HD22 ' HB2' ' A' ' 128' ' ' PHE . 40.4 mt -63.46 137.58 58.2 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -179.082 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 53.9 t -122.59 132.0 24.32 Favored Pre-proline 0 C--N 1.323 -0.573 0 C-N-CA 121.004 -0.279 . . . . 0.0 110.601 -172.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.44 110.88 0.78 Allowed 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.285 1.99 . . . . 0.0 110.638 173.27 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 110.45 -13.05 30.61 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.604 -175.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -108.0 172.43 6.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.762 0.315 . . . . 0.0 110.293 178.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.723 ' HB3' ' HB3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -79.15 138.24 37.81 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.056 -174.268 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.713 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -146.8 160.08 42.71 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.051 176.108 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 129' ' ' HIS . . . . . 0.506 ' HB3' HD11 ' A' ' 131' ' ' ILE . 8.3 m-70 -127.31 134.72 49.98 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.035 0.445 . . . . 0.0 111.035 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.563 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 12.9 t80 -124.22 103.21 8.11 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -179.783 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.514 HD12 HD12 ' A' ' 146' ' ' ILE . 0.0 OUTLIER -121.75 117.54 52.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.345 -179.635 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 52.7 t30 57.1 35.87 26.87 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.77 0.669 . . . . 0.0 110.842 177.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.563 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 75.21 35.53 48.42 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.617 -0.802 . . . . 0.0 113.109 179.494 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -130.75 139.17 50.23 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 117.126 0.463 . . . . 0.0 110.136 179.099 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.421 ' HB3' HD11 ' A' ' 122' ' ' LEU . 10.7 mt -94.55 116.14 28.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.081 0.467 . . . . 0.0 110.924 -177.19 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -125.69 159.76 31.43 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.307 177.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' CYS . . . . . 0.478 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 21.2 p -91.6 173.08 8.07 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 177.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.723 ' HB3' ' HB3' ' A' ' 127' ' ' ARG . 0.3 OUTLIER -74.76 -14.68 60.74 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 175.535 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 139' ' ' HIS . . . . . 0.478 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 15.4 t60 -84.46 -24.19 29.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.517 -177.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.489 ' OD2' ' HB ' ' A' ' 117' ' ' THR . 40.3 m-20 -120.77 17.88 11.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.349 -176.608 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.473 ' O ' ' HG3' ' A' ' 141' ' ' ARG . 4.5 ptm180 -53.67 120.81 24.42 Favored Pre-proline 0 C--O 1.235 0.305 0 CA-C-O 121.341 0.591 . . . . 0.0 111.307 -176.613 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 24.3 Cg_exo -64.13 128.99 23.01 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.908 2.405 . . . . 0.0 112.034 -179.103 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -98.06 -33.93 10.98 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.318 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -96.61 14.63 24.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.452 0.644 . . . . 0.0 110.471 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -146.0 55.93 1.18 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.603 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 146' ' ' ILE . . . . . 0.514 HD12 HD12 ' A' ' 131' ' ' ILE . 7.0 tt -164.95 -35.85 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.39 -176.448 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 45.68 69.09 0.49 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.73 0.644 . . . . 0.0 110.95 -175.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 109.89 -98.81 1.14 Allowed Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 -175.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 202' ' ' GLY . . . . . 0.441 ' HA2' HG12 ' A' ' 146' ' ' ILE . . . -178.26 170.88 43.18 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.6 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 7.1 m -78.36 80.99 4.73 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 122.45 0.3 . . . . 0.0 110.331 176.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 81.24 -50.59 4.22 Favored Glycine 0 N--CA 1.452 -0.239 0 N-CA-C 111.562 -0.615 . . . . 0.0 111.562 -175.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -152.12 -179.19 27.54 Favored Glycine 0 N--CA 1.441 -1.032 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 177.047 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.58 74.36 9.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.145 0.498 . . . . 0.0 110.81 179.675 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 112.17 98.11 2.38 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.343 176.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 208' ' ' SER . . . . . 0.408 ' O ' ' HA ' ' A' ' 127' ' ' ARG . 0.4 OUTLIER -90.14 174.88 7.38 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 177.997 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 49.7 mm -104.62 136.16 39.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.287 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -61.37 124.2 79.66 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.764 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 406' ' ' PRO . . . . . 0.4 ' HG3' ' HA ' ' A' ' 103' ' ' ALA . 11.5 Cg_endo -57.14 150.85 54.49 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.885 2.39 . . . . 0.0 112.373 178.647 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -86.03 155.32 58.08 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.321 -174.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 408' ' ' PRO . . . . . 0.507 ' HA ' ' HA ' ' A' ' 101' ' ' MET . 64.6 Cg_endo -76.49 117.41 4.56 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.586 2.191 . . . . 0.0 112.054 175.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -127.44 166.86 17.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.792 -178.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -74.77 109.92 8.64 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 176.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -89.83 -83.78 0.24 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.229 -174.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 412' ' ' LEU . 1.3 pt? -131.47 129.81 22.31 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.784 -176.034 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 413' ' ' PRO . . . . . 0.627 ' HB3' ' HB2' ' A' ' 96' ' ' ALA . 73.8 Cg_endo -80.68 121.18 4.08 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.509 2.139 . . . . 0.0 111.164 172.726 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.471 HG21 ' O ' ' A' ' 85' ' ' GLY . 32.4 p -93.47 -126.67 0.1 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -176.508 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 415' ' ' SER . . . . . 0.482 ' CB ' ' HA3' ' A' ' 82' ' ' GLY . 0.3 OUTLIER -90.37 173.11 8.29 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.017 0.437 . . . . 0.0 111.767 -176.428 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -104.93 141.15 21.96 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.558 -178.905 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -86.94 166.91 8.36 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.758 2.305 . . . . 0.0 113.092 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.981 0 CA-C-O 118.063 -0.97 . . . . 0.0 109.85 175.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.789 0 N-CA-C 112.268 -0.333 . . . . 0.0 112.268 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.32 -172.17 2.88 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 1.8 t80 66.92 79.13 0.24 Allowed 'General case' 0 C--N 1.331 -0.205 0 O-C-N 123.826 0.704 . . . . 0.0 111.606 175.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 1.1 mp -97.06 108.18 21.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.604 0.716 . . . . 0.0 110.223 177.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.607 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER -147.9 -1.34 0.59 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.189 176.059 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.79 109.3 9.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.707 179.321 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -78.16 93.89 4.64 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.483 0.659 . . . . 0.0 110.462 -177.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.527 ' HA3' ' HA ' ' A' ' 415' ' ' SER . . . 123.45 -20.11 7.47 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.073 -175.236 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 64.14 18.94 11.55 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.548 0.739 . . . . 0.0 112.302 176.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.406 ' OG ' ' HA ' ' A' ' 414' ' ' THR . 0.2 OUTLIER -91.74 -14.09 30.52 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.848 176.947 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 151.43 170.14 17.92 Favored Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.001 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -167.93 163.81 13.83 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 178.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.607 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 43.3 t -68.5 145.78 53.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.058 0.456 . . . . 0.0 110.111 175.284 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -94.74 -1.71 52.44 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.793 179.11 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.45 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -112.41 -51.68 2.83 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.866 0.365 . . . . 0.0 110.338 177.552 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 34.8 m -77.78 -52.89 8.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.843 175.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.607 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 96.82 1.76 59.9 Favored Glycine 0 N--CA 1.443 -0.845 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.768 -176.768 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.6 134.88 34.38 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 177.433 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' SER . . . . . 0.738 ' HB3' HG21 ' A' ' 414' ' ' THR . 1.0 OUTLIER -65.69 148.3 51.98 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.16 176.735 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.8 mt -103.37 116.18 62.56 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -168.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -77.53 167.28 24.55 Favored 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.833 2.355 . . . . 0.0 111.028 170.011 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.08 7.27 6.41 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -176.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.67 -35.67 14.81 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -175.836 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -96.49 127.32 42.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.881 0.372 . . . . 0.0 110.785 -176.305 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.608 HD23 ' HB2' ' A' ' 408' ' ' PRO . 0.8 OUTLIER -79.69 125.2 29.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.64 176.486 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.834 HG21 ' HB2' ' A' ' 411' ' ' ALA . 29.8 m -115.91 -172.48 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.244 -170.559 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.8 mmt -122.59 112.7 18.31 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.005 0.431 . . . . 0.0 110.057 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -109.44 119.89 40.83 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.36 -178.202 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -96.63 -171.8 2.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.1 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.58 63.88 4.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.367 0.603 . . . . 0.0 110.085 177.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 168.76 -102.32 0.18 Allowed Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.339 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -95.75 178.11 5.56 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.875 0.369 . . . . 0.0 110.729 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 9.6 p -123.76 143.46 36.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.221 0.534 . . . . 0.0 111.659 -174.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' TYR . . . . . 0.779 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 41.1 m-85 -127.76 -172.84 2.77 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 174.57 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.878 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 73.1 m80 -97.76 -164.53 1.15 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 172.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.6 pp -82.15 -23.57 35.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.895 0.379 . . . . 0.0 111.437 -178.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.427 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.56 -31.03 16.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.075 -175.343 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.878 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -78.79 -5.93 54.63 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.82 -176.342 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.33 76.6 1.86 Allowed 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.413 0.625 . . . . 0.0 110.5 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.665 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.7 OUTLIER -140.7 155.78 46.39 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.801 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 115' ' ' CYS . . . . . 0.533 ' HB2' ' N ' ' A' ' 119' ' ' ARG . 73.0 m -55.78 146.8 20.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.173 0.511 . . . . 0.0 111.369 175.306 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.73 -20.45 31.09 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.099 -179.586 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.3 -52.59 2.74 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.633 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 0.1 OUTLIER -94.56 -19.86 20.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.971 0.415 . . . . 0.0 111.08 -174.287 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.533 ' N ' ' HB2' ' A' ' 115' ' ' CYS . 4.9 mmt180 68.82 22.39 7.28 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.936 175.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ASN . . . . . 0.633 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 1.0 OUTLIER -63.9 130.23 43.26 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 171.725 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.665 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.6 OUTLIER -78.84 107.53 11.63 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.057 177.252 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.766 HD22 ' HA ' ' A' ' 128' ' ' PHE . 10.4 mt -63.99 139.73 58.8 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.441 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.477 ' O ' ' HB3' ' A' ' 405' ' ' ALA . 3.0 t -121.86 132.36 24.25 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.436 -170.498 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 123' ' ' VAL . 40.0 Cg_exo -55.42 110.72 0.59 Allowed 'Trans proline' 0 N--CA 1.461 -0.431 0 C-N-CA 122.59 2.193 . . . . 0.0 111.288 179.132 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 110.81 -16.29 28.4 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.583 -177.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.485 ' O ' ' HA ' ' A' ' 404' ' ' ILE . 3.3 t70 -116.61 -153.36 0.53 Allowed 'General case' 0 C--N 1.326 -0.423 0 O-C-N 122.665 -0.315 . . . . 0.0 110.641 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.64 139.54 43.65 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -171.221 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.766 ' HA ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -157.74 144.94 18.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.929 -1.032 . . . . 0.0 108.618 170.955 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 129' ' ' HIS . . . . . 0.496 ' CD2' ' HD2' ' A' ' 141' ' ' ARG . 8.3 m-70 -137.35 120.57 16.81 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.425 178.427 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.427 ' HB2' ' CE2' ' A' ' 128' ' ' PHE . 11.0 t80 -115.68 101.14 8.57 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 175.008 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -126.71 126.57 68.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.553 -178.099 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.2 t30 58.5 25.72 13.4 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.166 -178.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 78.57 36.38 29.92 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.388 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.571 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 0.5 OUTLIER -139.55 150.48 45.12 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -179.014 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 43.5 mt -104.22 123.61 47.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.741 0.305 . . . . 0.0 111.489 -174.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.571 ' CE2' ' HB2' ' A' ' 134' ' ' SER . 39.5 m-85 -138.17 178.52 7.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.383 -0.826 . . . . 0.0 108.863 176.701 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 28.4 p -130.78 -153.18 0.55 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.008 0.432 . . . . 0.0 109.953 174.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.421 ' HA ' ' HD3' ' A' ' 141' ' ' ARG . 1.5 tt0 -77.7 -27.29 50.68 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.458 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -84.17 -53.21 5.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.072 -171.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.553 ' CG ' ' HB3' ' A' ' 118' ' ' CYS . 3.4 p-10 -96.07 31.17 2.21 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.692 0.758 . . . . 0.0 110.741 -178.463 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.501 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 0.4 OUTLIER -62.29 126.3 87.54 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.855 179.828 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 142' ' ' PRO . . . . . 0.501 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 3.0 Cg_exo -73.93 124.94 9.52 Favored 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.993 2.462 . . . . 0.0 112.205 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.34 53.13 2.69 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.353 0.597 . . . . 0.0 110.905 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -150.43 -77.04 0.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.233 -179.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.69 91.25 7.91 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.769 177.619 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 12.5 tt -123.71 -26.31 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.47 -178.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 32.7 m-20 67.68 -78.38 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.07 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -105.33 104.08 2.27 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.856 -0.687 . . . . 0.0 111.769 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -166.77 92.0 0.1 Allowed Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.61 -178.268 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 48.8 m -63.57 -53.67 48.03 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.472 0.654 . . . . 0.0 109.95 174.249 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . -148.22 -56.14 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.643 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 175.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -94.37 179.13 37.42 Favored Glycine 0 N--CA 1.439 -1.123 0 N-CA-C 110.404 -1.078 . . . . 0.0 110.404 167.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -152.14 92.32 1.7 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 117.046 0.423 . . . . 0.0 110.035 178.452 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -79.87 85.44 1.29 Allowed Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.051 -0.595 . . . . 0.0 113.14 -174.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 208' ' ' SER . . . . . 0.629 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 4.9 m -107.46 129.6 54.93 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 171.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 404' ' ' ILE . . . . . 0.485 ' HA ' ' O ' ' A' ' 126' ' ' ASP . 50.8 mm -109.81 129.85 63.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.787 -172.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 405' ' ' ALA . . . . . 0.529 ' HB2' ' HB3' ' A' ' 128' ' ' PHE . . . -64.69 134.14 95.93 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.969 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 406' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 5.6 Cg_exo -73.88 -176.48 2.62 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 123.011 2.474 . . . . 0.0 112.053 179.333 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -107.09 155.54 39.07 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.867 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 408' ' ' PRO . . . . . 0.608 ' HB2' HD23 ' A' ' 99' ' ' LEU . 53.8 Cg_exo -53.12 134.66 57.06 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.813 2.342 . . . . 0.0 112.846 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.19 175.71 9.33 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.162 -178.155 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -91.23 134.15 34.8 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.051 178.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 411' ' ' ALA . . . . . 0.834 ' HB2' HG21 ' A' ' 100' ' ' VAL . . . -83.51 178.73 7.88 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.417 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.9 tp -72.45 120.57 81.27 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 174.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -55.11 121.41 9.86 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.663 2.242 . . . . 0.0 112.06 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.738 HG21 ' HB3' ' A' ' 93' ' ' SER . 0.2 OUTLIER -82.34 162.17 22.31 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.546 179.821 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 415' ' ' SER . . . . . 0.527 ' HA ' ' HA3' ' A' ' 82' ' ' GLY . 24.2 m 71.44 -174.8 0.17 Allowed 'General case' 0 CA--C 1.529 0.169 0 O-C-N 123.753 0.658 . . . . 0.0 110.058 -174.489 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -126.27 87.75 55.63 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -70.45 136.56 31.45 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.791 2.328 . . . . 0.0 111.881 -178.135 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 418' ' ' LYS . . . . . 0.405 ' H ' ' HG3' ' A' ' 418' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.274 -0.87 . . . . 0.0 110.085 178.642 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.782 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 9.3 ptt-85 . . . . . 0 N--CA 1.457 -0.122 0 CA-C-O 121.408 0.623 . . . . 0.0 109.691 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.949 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -94.5 46.73 1.15 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.535 -171.527 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 51.0 35.35 12.52 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 121.498 0.666 . . . . 0.0 110.874 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 121.38 -129.2 7.64 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 -173.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.589 ' HA ' HD12 ' A' ' 80' ' ' LEU . 64.6 t30 -142.74 79.84 1.67 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.128 0.49 . . . . 0.0 111.462 175.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.29 -55.48 2.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.947 174.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 177.79 144.35 5.42 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.822 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.949 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -160.51 158.79 29.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.642 0.221 . . . . 0.0 110.836 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.833 ' HB2' ' HA ' ' A' ' 108' ' ' TYR . 0.1 OUTLIER -86.83 145.76 26.48 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.982 178.474 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.2 -12.54 60.91 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.088 -0.383 . . . . 0.0 111.714 -178.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.527 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -82.86 -47.87 11.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.586 0.231 . . . . 0.0 110.718 -177.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 2.6 p -126.84 -42.87 1.73 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.753 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.782 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 75.19 15.74 80.97 Favored Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.842 -0.617 . . . . 0.0 113.682 179.158 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.3 76.0 8.25 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 117.184 0.492 . . . . 0.0 111.687 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.499 ' HA ' HG21 ' A' ' 414' ' ' THR . 0.7 OUTLIER 62.43 128.67 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 O-C-N 124.228 0.955 . . . . 0.0 113.458 172.765 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.686 HD13 HG11 ' A' ' 100' ' ' VAL . 1.3 mt -103.82 99.51 16.46 Favored Pre-proline 0 C--N 1.32 -0.69 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 170.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.452 ' HD3' ' O ' ' A' ' 93' ' ' SER . 5.4 Cg_exo -78.54 159.17 28.84 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.175 2.583 . . . . 0.0 112.103 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.95 -16.89 56.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.372 0.606 . . . . 0.0 109.674 174.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.1 -35.25 31.9 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.965 -178.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -100.74 118.45 36.86 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.452 ' O ' HD23 ' A' ' 110' ' ' LEU . 1.9 mt -68.78 139.4 55.28 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.66 -179.023 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.686 HG11 HD13 ' A' ' 94' ' ' ILE . 2.7 m -117.74 148.75 20.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.284 0.564 . . . . 0.0 111.38 -176.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.7 115.85 27.38 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.994 -177.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 18.6 ptt180 -112.04 135.46 52.65 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.333 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -113.67 -122.59 0.29 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.201 -177.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.23 -54.13 48.04 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.071 0.462 . . . . 0.0 111.506 -176.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -162.1 31.83 0.32 Allowed Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -140.56 158.77 43.5 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -177.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -120.53 139.76 46.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.691 -176.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . 0.833 ' HA ' ' HB2' ' A' ' 87' ' ' CYS . 74.5 m-85 -137.46 160.34 39.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.36 178.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.787 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 29.0 m80 -85.84 152.2 23.19 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.452 HD23 ' O ' ' A' ' 99' ' ' LEU . 1.5 pp -65.86 -21.17 66.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.0 0.428 . . . . 0.0 111.045 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.428 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.86 -23.47 21.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.196 0.522 . . . . 0.0 110.335 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.787 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 12.4 m -94.2 -2.3 52.73 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.331 -178.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . 0.602 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.0 OUTLIER -76.62 74.75 3.31 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.229 0.538 . . . . 0.0 110.33 177.127 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.482 HG22 ' HA ' ' A' ' 121' ' ' ARG . 2.2 p -130.6 154.26 48.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.06 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.565 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 17.0 p -72.56 150.91 42.73 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.099 0.476 . . . . 0.0 110.273 177.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.05 2.0 52.92 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.478 -177.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.62 -50.78 3.34 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -176.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.64 -2.78 10.92 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.841 0.353 . . . . 0.0 110.93 -177.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 62.24 41.15 10.78 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.782 -179.383 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . 0.623 HD22 ' HB2' ' A' ' 137' ' ' CYS . 10.7 t30 -89.44 128.78 35.99 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.482 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.0 OUTLIER -72.45 126.76 30.63 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.826 0.345 . . . . 0.0 110.316 -177.894 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.794 HD22 ' HB2' ' A' ' 128' ' ' PHE . 0.7 OUTLIER -80.86 132.88 35.5 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.564 179.625 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -127.24 139.28 34.7 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.789 -173.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.98 110.93 0.75 Allowed 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.213 1.942 . . . . 0.0 110.612 171.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 112.65 -5.83 26.16 Favored Glycine 0 N--CA 1.447 -0.586 0 N-CA-C 111.26 -0.736 . . . . 0.0 111.26 -174.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -117.52 165.7 13.24 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 176.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 2.0 mtm-85 -93.81 131.32 39.29 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.122 0.487 . . . . 0.0 111.348 -174.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.794 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -138.63 171.84 13.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.22 -179.386 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 86.1 m-70 -131.94 133.77 44.9 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.786 0.327 . . . . 0.0 110.776 178.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.487 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 69.2 t80 -125.47 101.61 7.01 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 1.5 mt -129.83 128.92 65.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.432 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 63.93 18.28 11.09 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 123.515 0.509 . . . . 0.0 110.992 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.487 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 81.82 30.52 35.28 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.225 -176.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.484 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.9 OUTLIER -126.13 155.33 41.84 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 -176.894 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.608 ' HB3' HD11 ' A' ' 122' ' ' LEU . 12.2 mt -108.21 123.7 49.16 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.161 0.505 . . . . 0.0 111.286 -174.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.645 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 22.1 m-85 -129.71 174.9 9.27 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 174.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . 0.623 ' HB2' HD22 ' A' ' 120' ' ' ASN . 10.4 p -127.62 -175.82 3.58 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.457 0.646 . . . . 0.0 111.589 -174.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.475 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -72.77 -25.52 61.2 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.279 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 47.4 t60 -76.9 -39.2 51.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.769 -175.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.486 ' OD1' ' HB3' ' A' ' 136' ' ' PHE . 1.7 p30 -85.28 -58.77 2.55 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.364 178.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . 0.408 ' N ' ' OD1' ' A' ' 140' ' ' ASP . 0.4 OUTLIER 55.27 72.29 1.09 Allowed Pre-proline 0 C--N 1.327 -0.397 0 C-N-CA 123.146 0.579 . . . . 0.0 111.971 174.019 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.0 99.51 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.39 2.06 . . . . 0.0 111.866 176.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -92.56 -21.25 20.2 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.53 -171.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -68.32 -24.41 64.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.601 -178.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -141.25 60.23 1.51 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.062 0.458 . . . . 0.0 111.253 -178.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.322 -0.6 0 CA-C-O 121.592 0.711 . . . . 0.0 110.102 176.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.453 0 N-CA-C 112.684 -0.166 . . . . 0.0 112.684 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.23 130.33 36.37 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.855 0.359 . . . . 0.0 110.755 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 35.7 mm -120.15 137.47 53.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.912 -176.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . 0.499 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -61.82 133.57 93.77 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.479 -177.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . 0.602 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 15.2 Cg_exo -68.69 172.48 11.51 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.111 2.541 . . . . 0.0 112.401 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -97.1 158.1 33.87 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.144 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . 0.416 ' HB2' ' HB2' ' A' ' 99' ' ' LEU . 14.2 Cg_endo -88.91 128.63 1.97 Allowed 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.762 2.308 . . . . 0.0 112.976 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -130.73 163.03 28.16 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -77.29 127.98 33.54 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 122.088 -0.383 . . . . 0.0 110.371 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -105.75 -84.29 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.56 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.423 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.4 OUTLIER -131.53 144.27 52.69 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.046 -176.118 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 5.6 Cg_exo -79.38 147.04 19.98 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.886 2.391 . . . . 0.0 111.037 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.499 HG21 ' HA ' ' A' ' 93' ' ' SER . 0.2 OUTLIER -86.55 147.62 25.87 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.831 0.348 . . . . 0.0 111.2 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 12.5 m . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.68 177.898 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.538 ' HE ' ' HA2' ' A' ' 91' ' ' GLY . 19.9 ptt180 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.983 0.42 . . . . 0.0 110.613 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.495 HD22 ' HB2' ' A' ' 86' ' ' ALA . 0.9 OUTLIER -113.08 -174.72 2.51 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.89 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -77.73 -35.97 51.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.96 0.409 . . . . 0.0 110.921 -177.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -116.34 -129.53 4.41 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 177.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 18.6 p30 -147.01 22.56 1.22 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.211 0.529 . . . . 0.0 110.356 175.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.87 -58.78 3.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.115 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 93' ' ' SER . . . -170.16 146.78 10.16 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 111.519 -0.633 . . . . 0.0 111.519 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.495 ' HB2' HD22 ' A' ' 80' ' ' LEU . . . -129.06 141.83 51.09 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.771 0.319 . . . . 0.0 110.986 -177.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.736 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 41.9 t -62.38 145.84 52.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.137 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.41 -25.42 42.09 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.611 176.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -96.0 -47.95 5.89 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.139 -177.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 56.0 m -83.06 -62.66 1.54 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.254 0.55 . . . . 0.0 110.244 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.736 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 118.19 -19.39 10.92 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.426 -175.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -78.11 177.38 8.38 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.937 0.399 . . . . 0.0 110.922 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 0.5 OUTLIER -84.76 173.82 10.38 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.699 -174.69 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.463 HG12 HG11 ' A' ' 100' ' ' VAL . 2.3 mp -110.38 110.36 58.08 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.862 177.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.4 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 3.1 Cg_exo -78.22 161.49 29.09 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 123.106 2.538 . . . . 0.0 112.127 177.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.19 -16.65 57.68 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.209 0.528 . . . . 0.0 110.987 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -93.8 -21.41 19.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.163 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.4 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 1.0 OUTLIER -101.04 108.61 20.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.216 0.531 . . . . 0.0 110.064 -179.514 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 14.2 mt -66.96 131.53 46.06 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.249 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.699 ' HB ' ' O ' ' A' ' 108' ' ' TYR . 17.3 m -117.36 166.95 11.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.995 -175.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.9 111.96 20.39 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.436 ' H ' ' HG3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -110.7 139.84 45.61 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.627 -175.914 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -119.78 -165.11 1.13 Allowed 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.134 179.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.01 87.19 7.38 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.909 0.385 . . . . 0.0 110.543 -178.397 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 140.82 -48.03 0.84 Allowed Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.47 176.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -142.59 175.73 9.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.599 0.237 . . . . 0.0 110.383 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 5.0 p -132.6 141.01 46.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.881 -176.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . 0.699 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 1.4 m-85 -120.18 -173.87 2.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.193 175.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.773 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 74.7 m80 -103.91 -157.67 0.62 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 177.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.45 HD12 ' HB3' ' A' ' 408' ' ' PRO . 0.3 OUTLIER -86.53 -22.29 26.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.008 176.248 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.84 -36.02 15.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.611 -174.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.773 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.62 -17.72 59.02 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.531 -174.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.87 85.35 0.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.766 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.49 HG23 ' HD2' ' A' ' 121' ' ' ARG . 0.6 OUTLIER -143.09 158.44 43.6 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.653 -178.42 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.47 ' HB3' ' H ' ' A' ' 120' ' ' ASN . 42.2 t -62.1 149.76 40.35 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.878 0.37 . . . . 0.0 110.182 175.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 3.5 m -92.68 -14.09 28.54 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.092 0.472 . . . . 0.0 110.579 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.79 -49.6 4.31 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.032 -178.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.09 4.58 13.69 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -174.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 63.9 13.2 7.4 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.466 0.707 . . . . 0.0 112.708 175.062 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . 0.558 HD22 ' HB2' ' A' ' 137' ' ' CYS . 13.4 t30 -63.66 123.86 19.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.816 -178.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.49 ' HD2' HG23 ' A' ' 114' ' ' THR . 0.7 OUTLIER -73.31 116.31 13.71 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.982 0.42 . . . . 0.0 110.894 179.282 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.596 HD22 ' HB2' ' A' ' 128' ' ' PHE . 0.7 OUTLIER -75.04 154.51 37.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.126 -179.506 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.496 HG23 ' CB ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -142.54 146.76 40.03 Favored Pre-proline 0 C--N 1.327 -0.402 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.868 -170.015 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -68.06 111.83 2.56 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.823 2.348 . . . . 0.0 111.768 175.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 113.85 -9.36 23.44 Favored Glycine 0 N--CA 1.448 -0.528 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 -177.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.496 ' CB ' HG23 ' A' ' 123' ' ' VAL . 6.4 t70 -105.42 -145.12 0.38 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 173.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.532 ' HD2' ' OE2' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -133.53 146.7 51.29 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.029 0.442 . . . . 0.0 110.992 179.127 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.596 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -143.1 145.4 32.82 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.458 178.148 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -109.39 126.39 53.38 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.108 0.48 . . . . 0.0 110.518 -178.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.449 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 4.6 t80 -124.2 101.5 7.23 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.509 HG21 ' HB3' ' A' ' 145' ' ' LEU . 0.5 OUTLIER -122.46 115.56 46.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.253 -178.709 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 12.1 t30 59.65 42.64 16.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.753 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.449 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 67.52 35.83 87.35 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.792 177.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 14.9 m -133.5 135.89 44.73 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 122.606 -0.35 . . . . 0.0 110.121 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 20.6 mt -89.48 120.94 31.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.93 -177.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 -130.11 167.84 17.71 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.442 177.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . 0.558 ' HB2' HD22 ' A' ' 120' ' ' ASN . 4.5 p -132.47 -169.44 2.23 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.076 0.465 . . . . 0.0 111.35 -177.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.532 ' OE2' ' HD2' ' A' ' 127' ' ' ARG . 5.1 mm-40 -72.69 -31.01 64.72 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.572 -173.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -66.24 -43.72 85.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.36 -173.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.466 ' OD2' ' HD3' ' A' ' 142' ' ' PRO . 14.9 p-10 -91.38 -49.85 6.12 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.733 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 41.73 69.56 2.04 Favored Pre-proline 0 N--CA 1.47 0.563 0 O-C-N 123.641 0.588 . . . . 0.0 111.543 178.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . 0.466 ' HD3' ' OD2' ' A' ' 140' ' ' ASP . 32.0 Cg_endo -62.55 92.67 0.14 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.134 2.556 . . . . 0.0 112.756 -174.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.98 6.87 5.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.728 -175.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -87.03 -12.0 48.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.915 172.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.509 ' HB3' HG21 ' A' ' 131' ' ' ILE . 0.5 OUTLIER -110.62 -50.64 2.94 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.321 178.61 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.417 ' H ' HG13 ' A' ' 146' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.208 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.442 0 N-CA-C 112.309 -0.316 . . . . 0.0 112.309 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.5 172.13 13.15 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -178.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 26.5 mm -84.42 -76.03 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . 0.4 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . 179.34 151.67 0.52 Allowed Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.616 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . 0.405 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 15.9 Cg_exo -68.92 -16.27 40.95 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.215 1.943 . . . . 0.0 110.649 172.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . 0.405 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 2.6 m-85 74.15 145.8 0.11 Allowed Pre-proline 0 C--N 1.34 0.158 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.214 177.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . 0.45 ' HB3' HD12 ' A' ' 110' ' ' LEU . 37.9 Cg_endo -67.23 115.32 3.6 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.306 2.004 . . . . 0.0 111.76 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -134.4 175.08 9.84 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.689 -177.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -100.32 135.58 41.54 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . 0.427 ' HB3' HG21 ' A' ' 94' ' ' ILE . . . -85.97 -102.99 0.06 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 175.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' A' ' 412' ' ' LEU . 17.2 mt -132.3 139.89 36.26 Favored Pre-proline 0 C--N 1.321 -0.655 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 174.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -53.75 133.46 54.32 Favored 'Trans proline' 0 C--O 1.236 0.388 0 C-N-CA 122.783 2.322 . . . . 0.0 112.218 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 5.7 m -58.33 141.39 51.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.518 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.346 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 171.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.641 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.311 0 CA-C-O 121.066 0.46 . . . . 0.0 110.637 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.569 HD11 ' H ' ' A' ' 84' ' ' SER . 0.4 OUTLIER -108.13 -178.97 3.76 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.035 -174.213 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -80.66 81.65 6.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.727 175.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 114.27 -134.56 11.83 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.774 -0.727 . . . . 0.0 111.315 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.432 ' HA ' HD21 ' A' ' 80' ' ' LEU . 53.1 p-10 -152.29 35.33 0.52 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.125 0.488 . . . . 0.0 110.822 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.569 ' H ' HD11 ' A' ' 80' ' ' LEU . 0.3 OUTLIER -106.62 -113.69 0.27 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.058 -179.613 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . 0.521 ' H ' ' HB2' ' A' ' 84' ' ' SER . . . -88.08 124.76 7.32 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.81 -176.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.447 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -140.16 160.53 39.75 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 177.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.87 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 42.2 t -78.55 145.17 34.98 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.432 0.634 . . . . 0.0 111.288 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.02 -11.51 50.19 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.935 177.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -107.58 -50.36 3.08 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.938 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 28.1 m -82.48 -54.36 5.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.449 0.643 . . . . 0.0 109.736 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.87 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 102.56 -10.37 56.13 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.153 -173.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.05 146.4 52.68 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 176.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.64 144.31 57.02 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.04 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.518 HG12 HG11 ' A' ' 100' ' ' VAL . 5.7 mt -93.72 118.6 67.44 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.237 178.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 94' ' ' ILE . 3.0 Cg_exo -77.21 144.56 23.51 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.998 2.465 . . . . 0.0 112.181 178.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.535 ' HB2' ' HB3' ' A' ' 413' ' ' PRO . . . -77.42 -6.34 53.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.2 0.524 . . . . 0.0 110.604 178.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.41 16.98 25.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.676 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -131.98 162.84 29.73 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.121 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' A' ' 409' ' ' GLU . 6.3 mt -106.69 116.06 31.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.167 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.518 HG11 HG12 ' A' ' 94' ' ' ILE . 4.5 m -119.37 150.82 21.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.156 -174.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.506 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -92.51 152.88 19.41 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.316 179.764 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.447 ' HB3' HG12 ' A' ' 107' ' ' VAL . 0.0 OUTLIER -153.9 159.78 41.89 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.855 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -122.4 -162.28 0.99 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.553 -178.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.72 12.08 2.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.163 -178.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -137.34 -81.3 0.1 OUTLIER Glycine 0 N--CA 1.442 -0.935 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.526 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -106.52 175.44 5.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.8 0.333 . . . . 0.0 111.754 -174.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.447 HG12 ' HB3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -108.31 149.83 11.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.126 -177.57 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . 0.492 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 32.2 m-85 -141.77 -168.72 2.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.254 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.76 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 74.6 m80 -110.58 -157.42 0.61 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 172.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -86.17 -23.17 26.63 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.907 0.384 . . . . 0.0 111.266 176.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.41 -36.99 15.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.791 -174.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.76 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -74.58 -13.06 60.61 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.234 -174.375 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -79.23 64.2 4.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.33 0.586 . . . . 0.0 109.996 175.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -125.17 154.88 40.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.483 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.425 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 12.5 t -62.91 135.93 57.57 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.258 0.552 . . . . 0.0 110.68 176.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 2.4 m -81.88 -17.5 47.06 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.697 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.32 -51.34 4.63 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -176.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 14.6 p -114.14 -7.09 13.05 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.379 -174.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.425 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 76.76 13.01 2.32 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.001 176.662 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -63.68 118.36 8.16 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 174.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.01 122.68 17.93 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 177.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.7 HD13 ' HD2' ' A' ' 128' ' ' PHE . 11.4 mt -68.08 127.22 32.08 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.339 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.5 ' HB ' ' CB ' ' A' ' 126' ' ' ASP . 71.0 t -107.61 134.12 20.14 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -172.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -55.82 109.95 0.49 Allowed 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 122.032 1.821 . . . . 0.0 111.018 175.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.37 6.5 56.58 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.507 -175.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.5 ' CB ' ' HB ' ' A' ' 123' ' ' VAL . 27.3 t0 -121.89 173.94 7.19 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 122.643 -0.328 . . . . 0.0 110.566 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.577 ' HB2' ' HG3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -65.34 140.82 58.7 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.22 0.533 . . . . 0.0 112.335 -176.569 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.7 ' HD2' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -156.64 170.26 22.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.404 -0.817 . . . . 0.0 108.844 177.516 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -146.16 137.48 24.66 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.692 0.282 . . . . 0.0 110.683 176.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -125.03 100.92 6.8 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.77 HG21 HG23 ' A' ' 146' ' ' ILE . 7.1 mm -120.13 104.35 15.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.147 -177.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.1 t30 56.54 55.83 6.13 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.545 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 63.9 33.08 86.28 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.36 -0.837 . . . . 0.0 113.243 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.438 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 1.2 m -131.84 132.83 44.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -178.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.524 ' HB3' HD11 ' A' ' 122' ' ' LEU . 38.2 mt -91.88 116.98 29.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.345 0.593 . . . . 0.0 111.107 -177.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.438 ' CE2' ' HB2' ' A' ' 134' ' ' SER . 61.4 m-85 -128.18 -179.47 5.02 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.238 -0.892 . . . . 0.0 108.712 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . 0.721 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 10.3 p -129.25 -178.91 4.85 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.036 0.446 . . . . 0.0 110.659 176.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.577 ' HG3' ' HB2' ' A' ' 127' ' ' ARG . 1.4 mm-40 -79.13 -14.19 59.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.387 179.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . 0.721 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 71.2 t60 -70.97 -47.22 60.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.26 0.552 . . . . 0.0 109.643 -178.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.52 29.73 5.9 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.571 175.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . 0.437 HH11 ' HD3' ' A' ' 141' ' ' ARG . 14.5 ttp180 -22.64 99.22 0.06 OUTLIER Pre-proline 0 N--CA 1.474 0.725 0 C-N-CA 125.812 1.645 . . . . 0.0 113.9 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . 0.413 ' HG3' ' CG ' ' A' ' 136' ' ' PHE . 46.4 Cg_endo -97.55 73.31 0.09 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.449 2.766 . . . . 0.0 112.989 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.41 169.98 8.43 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.142 -0.349 . . . . 0.0 111.247 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . 65.66 -84.21 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.484 0.714 . . . . 0.0 111.206 178.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -93.05 20.82 6.36 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 176.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.77 HG23 HG21 ' A' ' 131' ' ' ILE . 5.7 mt . . . . . 0 C--O 1.233 0.204 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.738 -171.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.486 0 N-CA-C 114.385 0.514 . . . . 0.0 114.385 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . 0.64 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 68.7 m -156.45 138.3 14.33 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 171.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 46.5 mm -118.89 137.08 54.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.539 0.209 . . . . 0.0 110.576 -174.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . 0.476 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -75.23 134.48 73.87 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.125 -178.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 14.7 Cg_exo -70.3 -178.67 2.67 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 123.482 2.788 . . . . 0.0 112.458 177.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -97.95 157.92 33.75 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.333 -177.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . 0.448 ' HB3' ' SD ' ' A' ' 101' ' ' MET . 97.1 Cg_endo -87.51 121.04 1.55 Allowed 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.719 2.279 . . . . 0.0 112.054 172.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . 0.409 ' HA ' HD22 ' A' ' 99' ' ' LEU . 0.0 OUTLIER -137.99 178.08 7.39 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.297 178.043 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -62.25 149.75 41.02 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.095 0.474 . . . . 0.0 111.458 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -136.32 -145.23 0.21 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.575 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 4.4 tp -73.01 128.18 88.3 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.733 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . 0.535 ' HB3' ' HB2' ' A' ' 96' ' ' ALA . 9.9 Cg_exo -72.17 168.96 22.67 Favored 'Trans proline' 0 CA--C 1.532 0.4 0 C-N-CA 123.095 2.53 . . . . 0.0 113.668 -175.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 90.8 m -92.49 133.08 36.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.594 178.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 69.4 m . . . . . 0 CA--C 1.533 0.294 0 O-C-N 123.329 0.393 . . . . 0.0 111.255 179.576 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.804 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 39.1 ttp180 . . . . . 0 CA--C 1.518 -0.254 0 CA-C-O 121.481 0.657 . . . . 0.0 110.784 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.47 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -82.15 127.02 32.72 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.348 178.13 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -66.83 105.17 1.51 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.471 ' O ' ' HB2' ' A' ' 83' ' ' ASN . . . 94.93 -94.26 1.73 Allowed Glycine 0 N--CA 1.442 -0.964 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 -172.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 5.0 t-20 170.24 167.48 0.06 Allowed 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 177.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.7 m 71.03 -60.94 0.5 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 172.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . 0.401 ' O ' ' HA ' ' A' ' 93' ' ' SER . . . -79.69 71.86 2.64 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.37 -172.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.47 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -148.18 170.78 17.11 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 122.293 0.237 . . . . 0.0 110.381 179.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.81 145.78 30.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.999 0.428 . . . . 0.0 110.231 -179.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.37 -8.31 55.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.542 -172.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.711 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -88.65 -54.11 4.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.642 0.258 . . . . 0.0 111.453 -176.187 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 31.5 p -98.28 -39.84 8.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.063 0.459 . . . . 0.0 110.509 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.804 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 96.77 8.74 56.91 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-N 115.652 -0.703 . . . . 0.0 112.223 -178.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.547 ' HA ' HE21 ' A' ' 92' ' ' GLN . 1.1 tp60 -89.24 155.62 19.28 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.781 0.324 . . . . 0.0 110.321 177.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.509 ' HB3' ' HB ' ' A' ' 414' ' ' THR . 13.9 m -71.39 160.27 33.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.472 -174.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 23.3 mt -101.14 111.23 63.2 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.219 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.73 148.0 22.31 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 123.021 2.481 . . . . 0.0 111.3 172.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.94 -11.78 61.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.037 0.446 . . . . 0.0 111.594 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.85 1.0 57.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.26 0.552 . . . . 0.0 110.797 179.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.07 175.38 5.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.912 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.648 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 32.0 mt -124.11 133.17 53.67 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.694 0.283 . . . . 0.0 110.337 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -115.96 142.29 29.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.364 0.602 . . . . 0.0 110.6 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 5.1 mmt -85.56 113.98 22.22 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.788 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -99.44 121.93 41.83 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.203 -178.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -104.71 -83.34 0.5 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.769 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -123.64 60.2 1.1 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.24 0.543 . . . . 0.0 110.279 -179.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.65 -17.37 45.12 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.105 -179.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -92.38 157.94 16.34 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 177.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -131.81 144.01 38.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.994 0.426 . . . . 0.0 111.745 -175.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . 0.409 ' HD1' ' HB2' ' A' ' 89' ' ' ALA . 92.9 m-85 -138.7 165.96 25.61 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 175.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.832 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 30.6 m80 -87.44 168.92 12.68 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.482 178.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' A' ' 110' ' ' LEU . 0.4 OUTLIER -62.58 -31.22 72.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.247 0.546 . . . . 0.0 110.983 177.906 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.459 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.48 -20.78 23.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.905 179.388 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.832 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 35.3 m -91.27 -4.13 56.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.624 -174.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . 0.557 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.1 OUTLIER -85.16 91.83 8.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.952 0.406 . . . . 0.0 110.553 178.025 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.595 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.7 OUTLIER -146.43 156.19 43.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.237 -177.288 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.549 ' HB2' ' HB3' ' A' ' 137' ' ' CYS . 0.0 OUTLIER -70.82 152.64 43.52 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 169.501 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 1.4 p -93.21 -22.01 19.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -174.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.2 -51.05 4.56 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -172.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.701 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -101.57 -8.69 21.65 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.522 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.4 OUTLIER 62.78 44.75 6.21 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.429 -179.772 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . 0.492 ' H ' ' HB3' ' A' ' 115' ' ' CYS . 44.3 t30 -80.44 118.55 22.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.597 176.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.595 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.9 OUTLIER -69.58 108.04 3.66 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 177.719 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.441 ' H ' ' HG ' ' A' ' 122' ' ' LEU . 0.6 OUTLIER -70.8 129.06 38.11 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.688 -179.669 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.2 t -145.26 146.71 31.37 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.778 -173.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.79 111.69 0.76 Allowed 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.63 2.22 . . . . 0.0 111.635 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.22 -19.77 13.09 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.338 -0.705 . . . . 0.0 111.338 -176.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.423 ' CG ' ' H ' ' A' ' 127' ' ' ARG . 9.6 t70 -101.93 -152.82 0.44 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.423 ' H ' ' CG ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -121.56 155.19 35.55 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.765 0.317 . . . . 0.0 110.815 -174.2 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.546 ' CE2' ' HB2' ' A' ' 130' ' ' TYR . 0.2 OUTLIER -157.61 143.31 17.31 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.655 174.3 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . 0.466 ' HE2' ' CD ' ' A' ' 138' ' ' GLU . 51.7 m-70 -121.33 122.81 40.67 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.831 0.348 . . . . 0.0 110.078 178.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.546 ' HB2' ' CE2' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -119.82 101.77 8.11 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 178.813 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.646 HD11 HD12 ' A' ' 146' ' ' ILE . 1.5 mt -108.52 103.21 15.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.13 -178.027 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.1 t30 58.17 28.5 16.58 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.803 177.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.409 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 92.75 30.17 9.93 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.775 -179.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -125.9 126.63 44.72 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 176.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.427 HD22 ' CD1' ' A' ' 122' ' ' LEU . 14.6 mt -91.66 115.7 28.27 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -174.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -136.38 179.01 6.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.461 176.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . 0.652 ' SG ' ' HB2' ' A' ' 139' ' ' HIS . 1.1 p -137.84 179.19 6.57 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.719 0.295 . . . . 0.0 110.792 176.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.466 ' CD ' ' HE2' ' A' ' 129' ' ' HIS . 6.8 mm-40 -73.72 -16.07 61.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.284 -176.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . 0.652 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 0.2 OUTLIER -78.43 -11.07 59.93 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.698 0.285 . . . . 0.0 110.885 -176.644 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.701 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 10.4 p-10 -127.82 -47.37 1.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.225 177.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . 0.408 ' HD3' HG21 ' A' ' 146' ' ' ILE . 0.0 OUTLIER 46.77 68.43 3.47 Favored Pre-proline 0 N--CA 1.47 0.569 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 172.89 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . 0.44 ' HD3' ' OD2' ' A' ' 140' ' ' ASP . 66.1 Cg_endo -94.6 -172.99 0.29 Allowed 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 122.884 2.389 . . . . 0.0 112.837 178.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . 0.421 ' C ' ' H ' ' A' ' 145' ' ' LEU . 5.8 m 75.26 121.83 0.04 OUTLIER 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.226 -176.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -75.5 39.95 0.17 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.148 0.499 . . . . 0.0 111.023 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.421 ' H ' ' C ' ' A' ' 143' ' ' THR . 1.9 mt -162.69 27.06 0.1 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.093 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.646 HD12 HD11 ' A' ' 131' ' ' ILE . 3.0 tt . . . . . 0 C--N 1.327 -0.384 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.088 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.465 0 N-CA-C 111.897 -0.481 . . . . 0.0 111.897 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 40.6 m -155.52 136.16 13.42 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.941 0.4 . . . . 0.0 110.582 177.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 15.0 mm -93.85 136.16 26.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.232 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . 0.47 ' HA ' ' CD1' ' A' ' 128' ' ' PHE . . . -60.72 143.0 91.41 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.311 -178.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . 0.557 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 71.9 Cg_endo -74.68 -164.35 0.22 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.723 2.282 . . . . 0.0 112.541 179.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -117.07 146.07 37.17 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.086 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . 0.648 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 74.1 Cg_endo -77.1 125.52 7.98 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 122.551 2.167 . . . . 0.0 112.267 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -130.33 152.75 49.4 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.55 178.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -77.1 110.68 11.96 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.085 0.469 . . . . 0.0 110.376 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -93.85 -135.52 0.18 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.074 -178.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.497 ' H ' ' HG ' ' A' ' 412' ' ' LEU . 0.1 OUTLIER -81.22 129.26 67.52 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 179.508 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -78.83 164.98 24.97 Favored 'Trans proline' 0 C--O 1.237 0.47 0 C-N-CA 122.654 2.236 . . . . 0.0 112.586 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.509 ' HB ' ' HB3' ' A' ' 93' ' ' SER . 4.1 t -75.55 164.7 26.07 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.972 179.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.635 177.092 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.1 0 CA-C-O 120.955 0.407 . . . . 0.0 110.163 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.707 HD21 ' HB ' ' A' ' 414' ' ' THR . 0.3 OUTLIER -162.58 158.23 23.11 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.096 -179.414 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -62.59 -63.77 1.12 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.082 178.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -96.85 9.46 65.99 Favored Glycine 0 C--O 1.229 -0.19 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.402 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.54 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 5.2 t-20 61.01 94.49 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.482 0.658 . . . . 0.0 111.958 -178.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.436 ' HB2' HG22 ' A' ' 414' ' ' THR . 0.7 OUTLIER -146.82 -146.15 0.19 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 177.498 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.54 108.78 2.67 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.457 -0.878 . . . . 0.0 111.97 176.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.655 ' HB2' HD12 ' A' ' 80' ' ' LEU . . . -110.52 150.57 28.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.815 0.341 . . . . 0.0 111.381 -176.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -73.39 128.57 35.87 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 175.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.59 -5.39 47.54 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.638 -172.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.489 ' CB ' ' HB3' ' A' ' 112' ' ' CYS . . . -84.64 -46.93 11.02 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 121.039 -0.264 . . . . 0.0 110.738 -177.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.544 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 31.2 p -110.18 -74.65 0.64 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.192 -178.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.544 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 134.81 7.07 2.14 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 111.476 -0.649 . . . . 0.0 111.476 -176.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -73.88 131.45 41.5 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.059 0.457 . . . . 0.0 110.436 178.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.494 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 1.4 m -69.03 121.18 16.13 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.839 175.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.6 mp -74.89 113.52 25.51 Favored Pre-proline 0 C--N 1.326 -0.427 0 O-C-N 123.62 0.575 . . . . 0.0 112.287 -172.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.494 ' HD3' ' O ' ' A' ' 93' ' ' SER . 5.6 Cg_exo -80.56 167.49 18.93 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 123.407 2.738 . . . . 0.0 110.879 167.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.68 -1.47 24.93 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.056 0.455 . . . . 0.0 111.063 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.62 -29.09 22.82 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.071 178.258 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -85.97 173.89 9.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.502 -178.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.485 ' HB2' HD22 ' A' ' 110' ' ' LEU . 25.5 mt -125.73 128.77 48.28 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.592 -178.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.08 147.74 30.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.99 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 1.9 mtt -105.14 155.55 18.91 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.44 177.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 93.0 mtm-85 -112.6 98.69 7.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.677 0.275 . . . . 0.0 110.331 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -79.95 -36.36 36.31 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.121 0.486 . . . . 0.0 110.42 178.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.484 ' HB2' ' H ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -152.63 -127.45 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.675 178.69 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.484 ' H ' ' HB2' ' A' ' 104' ' ' GLN . . . -78.08 -26.31 60.28 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.741 -0.742 . . . . 0.0 111.853 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -103.27 162.31 13.1 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.937 0.399 . . . . 0.0 110.297 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 2.4 m -103.39 160.56 4.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.423 -176.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -137.29 143.1 41.98 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.634 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 7.6 m80 -69.27 161.87 28.36 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.871 0.367 . . . . 0.0 111.581 -177.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.485 HD22 ' HB2' ' A' ' 99' ' ' LEU . 0.3 OUTLIER -67.34 -27.63 67.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.231 0.538 . . . . 0.0 109.99 173.226 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.6 -23.19 22.01 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.738 178.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.634 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 63.6 m -94.77 -18.71 21.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.379 -176.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . 0.465 ' HD1' ' HA ' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -67.5 82.75 0.16 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.578 0.704 . . . . 0.0 110.508 177.029 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.604 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.5 p -135.47 160.99 36.73 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.693 -178.015 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.436 ' SG ' ' N ' ' A' ' 119' ' ' ARG . 26.2 p -72.73 149.94 43.3 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.349 0.595 . . . . 0.0 111.078 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.77 -2.27 58.51 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.455 179.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.575 ' HB ' ' SG ' ' A' ' 118' ' ' CYS . 0.8 OUTLIER -90.41 -54.68 3.9 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.65 -177.884 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.682 ' SG ' ' HB2' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -123.75 -20.9 5.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.231 -172.481 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.439 ' HB2' ' O ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER 81.02 50.97 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 123.812 0.845 . . . . 0.0 111.288 -179.289 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -97.32 151.65 19.69 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 169.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.604 ' HA ' HG22 ' A' ' 114' ' ' THR . 1.1 ttm180 -86.15 130.14 34.62 Favored 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.005 -176.297 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.419 HD13 ' HB2' ' A' ' 128' ' ' PHE . 16.0 mt -77.25 158.42 30.27 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 173.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -134.39 139.12 31.83 Favored Pre-proline 0 C--N 1.325 -0.476 0 C-N-CA 119.967 -0.693 . . . . 0.0 111.35 -169.046 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.437 ' HB3' ' HD3' ' A' ' 408' ' ' PRO . 11.7 Cg_endo -55.68 121.63 10.3 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 123.075 2.516 . . . . 0.0 111.874 177.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 91.0 -2.06 78.81 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.438 -0.887 . . . . 0.0 112.331 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -112.26 -179.2 3.61 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 177.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.511 ' HG2' HD13 ' A' ' 404' ' ' ILE . 1.3 mtt85 -88.78 149.14 23.57 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.417 0.627 . . . . 0.0 112.314 -171.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.419 ' HB2' HD13 ' A' ' 122' ' ' LEU . 0.6 OUTLIER -148.91 145.58 27.48 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 175.721 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . 0.57 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 60.8 m-70 -115.31 121.65 43.52 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.76 0.314 . . . . 0.0 110.915 -175.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.501 ' HA ' ' O ' ' A' ' 134' ' ' SER . 1.4 t80 -112.58 100.78 8.99 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 174.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.489 ' HB ' ' CE2' ' A' ' 136' ' ' PHE . 8.4 mt -124.04 124.01 67.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.198 -175.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 61.1 33.96 19.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.237 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 69.39 35.1 75.4 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.869 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.501 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.8 OUTLIER -131.67 154.24 49.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.798 0.299 . . . . 0.0 110.359 -178.046 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 13.2 mt -96.54 114.59 26.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.497 -177.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.57 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 30.9 m-85 -120.43 157.26 29.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.343 0.592 . . . . 0.0 110.414 179.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . 0.562 ' HB2' ' H ' ' A' ' 140' ' ' ASP . 0.5 OUTLIER -92.55 152.41 19.64 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.921 -175.233 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.428 ' OE1' ' HD2' ' A' ' 127' ' ' ARG . 16.8 tp10 -80.37 -24.83 39.5 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.731 0.776 . . . . 0.0 108.909 161.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -81.54 -52.55 7.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.931 -171.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.682 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -114.94 34.39 4.86 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -178.322 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . 0.481 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 9.9 ttp-105 -48.4 129.38 13.23 Favored Pre-proline 0 N--CA 1.464 0.27 0 CA-C-N 114.323 -1.308 . . . . 0.0 112.511 -173.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 21.2 Cg_exo -66.03 141.4 63.92 Favored 'Trans proline' 0 C--O 1.235 0.358 0 C-N-CA 122.829 2.353 . . . . 0.0 112.086 178.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.11 -3.9 57.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.558 -179.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -97.55 -74.14 0.58 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.808 -176.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.496 ' H ' ' HG ' ' A' ' 145' ' ' LEU . 0.0 OUTLIER -84.12 85.77 7.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.922 0.392 . . . . 0.0 111.08 -176.159 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.326 -0.433 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.991 176.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.684 0 N-CA-C 112.183 -0.367 . . . . 0.0 112.183 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.43 -176.15 2.91 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.137 0.494 . . . . 0.0 111.316 -176.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . 0.511 HD13 ' HG2' ' A' ' 127' ' ' ARG . 10.7 mm -111.38 135.54 50.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 176.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -59.5 113.21 6.53 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 177.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . 0.466 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 83.7 Cg_exo -45.64 -72.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.655 2.904 . . . . 0.0 112.819 -172.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . 0.466 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 1.1 t80 168.95 139.28 0.05 OUTLIER Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.147 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . 0.437 ' HD3' ' HB3' ' A' ' 124' ' ' PRO . 73.1 Cg_endo -85.87 107.13 0.9 Allowed 'Trans proline' 0 N--CA 1.446 -1.323 0 C-N-CA 122.22 1.947 . . . . 0.0 110.907 171.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -129.81 168.98 15.74 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.428 -175.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -77.22 111.12 12.51 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.203 177.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -89.2 -168.63 2.23 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.966 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.428 ' H ' ' HG ' ' A' ' 412' ' ' LEU . 0.1 OUTLIER -64.68 121.17 71.71 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.27 179.408 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -57.26 127.48 25.77 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.773 2.315 . . . . 0.0 111.815 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.707 ' HB ' HD21 ' A' ' 80' ' ' LEU . 34.0 p -85.3 161.13 19.65 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.567 -175.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 CA--C 1.532 0.271 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.038 -179.392 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 48.1 ttt85 . . . . . 0 CA--C 1.521 -0.164 0 CA-C-O 121.141 0.496 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.685 ' HB3' ' HA ' ' A' ' 83' ' ' ASN . 6.5 mp -83.97 10.76 9.07 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.586 -175.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.406 ' C ' ' H ' ' A' ' 83' ' ' ASN . 0.3 OUTLIER 49.28 84.48 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.558 0 O-C-N 123.803 0.69 . . . . 0.0 111.805 177.039 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.08 -16.98 19.35 Favored Glycine 0 C--O 1.228 -0.253 0 C-N-CA 120.306 -0.95 . . . . 0.0 111.083 -174.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.685 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 1.8 t30 71.11 54.39 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 123.654 0.781 . . . . 0.0 111.3 175.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.68 -58.44 1.88 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.565 177.215 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -155.38 142.82 9.23 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.615 -0.803 . . . . 0.0 112.382 -178.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.519 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . . . -154.24 171.11 19.74 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.517 ' HB2' ' HA ' ' A' ' 108' ' ' TYR . 0.1 OUTLIER -95.76 145.04 25.63 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.1 m -82.01 6.37 16.35 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -174.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.642 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -96.98 -59.59 1.76 Allowed 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.86 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.446 ' SG ' ' HB2' ' A' ' 92' ' ' GLN . 19.8 p -92.72 -36.76 12.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.85 0.357 . . . . 0.0 110.108 178.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 98.04 -3.37 60.29 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.487 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.446 ' HB2' ' SG ' ' A' ' 90' ' ' CYS . 0.0 OUTLIER -81.18 159.14 24.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.937 0.398 . . . . 0.0 110.612 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.24 164.82 17.45 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.651 -173.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.5 mt -113.83 99.83 50.97 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.807 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -77.04 159.68 33.79 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.589 2.193 . . . . 0.0 111.243 174.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -70.07 -10.07 57.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.132 0.491 . . . . 0.0 111.125 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.51 -13.32 52.21 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.002 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -117.25 147.78 42.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.977 -178.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.633 ' HB2' ' HB2' ' A' ' 408' ' ' PRO . 1.0 OUTLIER -108.43 141.6 40.05 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.857 -179.657 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -115.59 139.66 40.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.139 0.495 . . . . 0.0 111.125 -177.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.19 122.1 28.89 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.659 177.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.482 HH21 ' CD ' ' A' ' 409' ' ' GLU . 0.0 OUTLIER -113.75 142.16 46.39 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.219 -178.649 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -118.48 -76.54 0.57 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.531 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.508 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 0.2 OUTLIER -90.64 -93.64 0.13 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.145 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.508 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -120.16 0.16 13.01 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.4 175.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -103.07 163.67 12.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.746 0.307 . . . . 0.0 110.821 -177.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.2 m -134.91 148.12 29.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.329 -178.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . 0.517 ' HA ' ' HB2' ' A' ' 87' ' ' CYS . 6.1 m-85 -138.67 146.59 41.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.68 177.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.933 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 54.2 m80 -72.33 168.74 17.73 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.442 HD21 ' HG3' ' A' ' 408' ' ' PRO . 0.3 OUTLIER -63.02 -31.85 73.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.207 0.527 . . . . 0.0 110.939 178.887 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.475 ' HG3' ' SG ' ' A' ' 112' ' ' CYS . 3.4 pttp -89.35 0.65 56.66 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.05 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.933 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 4.6 m -117.41 -10.1 10.76 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.557 -176.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.6 69.68 2.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.549 0.69 . . . . 0.0 110.251 176.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.749 HG22 ' HA ' ' A' ' 121' ' ' ARG . 19.7 p -138.71 153.45 48.51 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.152 -0.931 . . . . 0.0 109.425 -178.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.488 ' HB3' ' HA ' ' A' ' 136' ' ' PHE . 3.6 p -71.89 153.2 42.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.059 0.457 . . . . 0.0 110.673 179.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -84.15 -8.02 59.2 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.063 0.459 . . . . 0.0 110.727 178.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.16 -51.11 5.76 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.925 -178.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.61 -6.45 10.19 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.487 -177.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.453 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 61.78 35.86 16.51 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.063 0.459 . . . . 0.0 110.551 -179.272 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . 0.636 HD22 ' HB2' ' A' ' 137' ' ' CYS . 49.2 t30 -80.95 131.61 35.34 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.643 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.749 ' HA ' HG22 ' A' ' 114' ' ' THR . 1.1 tpp85 -72.65 115.42 11.9 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.97 -178.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.475 HD13 ' HD2' ' A' ' 128' ' ' PHE . 5.6 mt -74.97 139.62 43.09 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 177.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -131.28 133.23 24.29 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-O 120.704 0.287 . . . . 0.0 111.603 -169.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -60.9 113.23 1.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.481 2.12 . . . . 0.0 110.538 171.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 120.21 -22.59 8.4 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 110.748 -0.941 . . . . 0.0 110.748 -173.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.01 -175.46 2.69 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.445 ' HB3' ' HG2' ' A' ' 138' ' ' GLU . 8.7 ttm-85 -99.07 148.37 24.11 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.849 0.357 . . . . 0.0 111.159 -173.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.475 ' HD2' HD13 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -143.2 156.76 44.83 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.508 176.366 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . 0.6 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 4.6 m-70 -117.39 117.89 30.72 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.001 0.429 . . . . 0.0 110.517 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.457 ' HA ' ' O ' ' A' ' 134' ' ' SER . 16.3 t80 -118.75 101.67 8.26 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 176.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -124.62 113.75 37.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.574 -177.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 7.0 t30 56.67 41.07 28.87 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.226 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 75.04 33.48 54.65 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.748 -0.739 . . . . 0.0 113.019 177.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.457 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.6 OUTLIER -126.98 145.45 50.7 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.828 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 79.1 mt -101.35 124.46 47.07 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.339 0.399 . . . . 0.0 110.967 -176.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.6 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 76.4 m-85 -135.95 164.4 28.06 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.613 175.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . 0.636 ' HB2' HD22 ' A' ' 120' ' ' ASN . 30.9 p -113.55 -167.23 1.17 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.28 0.562 . . . . 0.0 111.844 -175.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.445 ' HG2' ' HB3' ' A' ' 127' ' ' ARG . 1.3 mt-10 -75.36 -30.08 60.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.261 176.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . 0.481 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 77.6 t60 -73.84 -30.87 62.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.113 177.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.578 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.9 OUTLIER -66.47 -80.89 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.095 175.182 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 48.97 59.65 16.78 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.362 -177.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . 0.551 ' HD3' ' HB3' ' A' ' 140' ' ' ASP . 37.6 Cg_endo -66.01 92.37 0.26 Allowed 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.849 2.366 . . . . 0.0 112.03 -175.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . 0.442 ' HA ' HG12 ' A' ' 146' ' ' ILE . 0.2 OUTLIER -76.23 58.86 1.31 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.371 -178.529 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -125.68 -65.88 0.97 Allowed 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.469 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -115.73 43.06 2.17 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.076 0.465 . . . . 0.0 110.266 179.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.442 HG12 ' HA ' ' A' ' 143' ' ' THR . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.833 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.528 0 N-CA-C 111.634 -0.586 . . . . 0.0 111.634 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.62 167.42 11.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.92 0.39 . . . . 0.0 110.686 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 46.9 mm -76.19 130.14 36.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -56.67 130.77 77.71 Favored Pre-proline 0 C--N 1.33 -0.247 0 O-C-N 123.337 0.398 . . . . 0.0 111.346 -177.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.78 162.07 30.01 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.851 2.368 . . . . 0.0 112.169 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -88.45 152.69 50.05 Favored Pre-proline 0 C--N 1.319 -0.758 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.043 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . 0.633 ' HB2' ' HB2' ' A' ' 99' ' ' LEU . 51.2 Cg_endo -70.27 126.62 13.17 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 122.161 1.907 . . . . 0.0 111.758 176.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . 0.482 ' CD ' HH21 ' A' ' 102' ' ' ARG . 2.6 mt-10 -127.0 160.7 30.32 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.465 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -79.5 123.52 27.64 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.651 -0.499 . . . . 0.0 109.651 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -103.38 -106.3 0.28 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.22 -177.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.78 117.23 37.8 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.42 131.94 26.07 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.578 2.186 . . . . 0.0 112.773 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 19.2 m -56.36 142.0 39.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.045 -0.98 . . . . 0.0 111.084 174.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 11.1 m . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.107 -176.016 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.8 mtp85 . . . . . 0 N--CA 1.461 0.122 0 CA-C-O 121.279 0.562 . . . . 0.0 109.954 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.612 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 1.4 pt? -121.01 -179.43 4.02 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.494 -169.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -105.81 141.81 36.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.224 175.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.64 -40.95 2.99 Favored Glycine 0 CA--C 1.517 0.2 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.616 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.598 ' HA ' HD21 ' A' ' 80' ' ' LEU . 2.3 t-20 81.75 33.76 0.1 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.637 0.775 . . . . 0.0 112.198 175.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.449 ' N ' HD11 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -130.25 66.99 1.48 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.282 177.032 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 117.65 98.18 1.95 Allowed Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.459 -0.877 . . . . 0.0 113.093 175.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.612 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -138.33 156.47 47.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.144 0.497 . . . . 0.0 110.838 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 4.6 t -70.4 146.57 50.31 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.392 178.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.94 8.54 39.36 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.525 172.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.453 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -120.94 -59.62 1.72 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.453 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.487 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 30.3 p -93.09 -77.61 0.44 Allowed 'General case' 0 C--O 1.233 0.207 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.541 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.487 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 145.84 -3.03 1.08 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.642 -0.789 . . . . 0.0 113.142 176.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.9 tp60 -63.89 128.39 35.59 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 117.275 0.538 . . . . 0.0 110.616 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.857 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.7 OUTLIER -56.34 120.79 8.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.804 -0.634 . . . . 0.0 109.54 172.389 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.401 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 5.1 mt -75.89 113.39 26.83 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 112.224 0.454 . . . . 0.0 112.224 -172.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.677 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 5.7 Cg_exo -78.19 167.68 22.9 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.373 2.715 . . . . 0.0 111.083 172.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.19 -2.87 26.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.86 0.362 . . . . 0.0 111.16 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.93 8.38 34.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.954 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.677 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 1.6 mm-40 -119.03 134.54 55.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.885 177.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.543 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 1.4 mt -100.82 136.63 40.37 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.061 0.458 . . . . 0.0 110.342 -178.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 1.6 m -115.37 136.5 51.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.718 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.461 ' SD ' ' HG3' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -84.26 123.42 30.12 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.068 -179.446 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 13.2 ptt85 -90.24 121.46 32.28 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.103 -177.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -105.13 -27.35 11.65 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.922 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -179.41 -128.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.811 -178.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -78.33 -8.29 87.57 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.567 -0.825 . . . . 0.0 111.252 173.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 28.5 m-20 -102.93 142.05 34.7 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 177.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -126.49 141.54 45.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.005 0.431 . . . . 0.0 110.896 -177.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -129.29 172.77 11.15 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 177.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.795 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 13.9 m80 -85.17 170.73 12.59 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 177.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.416 ' HA ' ' SD ' ' A' ' 101' ' ' MET . 0.3 OUTLIER -69.63 -23.54 63.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.32 0.581 . . . . 0.0 109.521 173.578 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.485 ' HG2' ' HB3' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -90.25 -18.75 25.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.409 176.469 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.795 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 55.6 m -100.78 7.39 43.81 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.241 0.543 . . . . 0.0 111.06 -176.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . 0.453 ' HD1' ' HA ' ' A' ' 113' ' ' PHE . 0.1 OUTLIER -89.69 73.06 7.68 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.3 0.571 . . . . 0.0 110.273 177.84 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.628 HG22 ' HA ' ' A' ' 121' ' ' ARG . 15.2 p -133.48 155.7 49.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.145 -179.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 26.8 p -73.21 153.49 40.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.048 0.451 . . . . 0.0 110.816 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.49 2.16 42.3 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.977 -176.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -109.05 -51.63 2.86 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -179.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.95 -10.5 13.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.899 0.381 . . . . 0.0 110.941 -177.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 58.84 35.53 24.28 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.201 -177.006 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -73.87 120.8 19.96 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 174.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.628 ' HA ' HG22 ' A' ' 114' ' ' THR . 3.6 ttm180 -66.83 124.91 24.25 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.986 0.422 . . . . 0.0 110.749 -178.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.744 HD22 ' HB2' ' A' ' 128' ' ' PHE . 1.7 mt -76.75 158.91 30.58 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.138 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.547 ' O ' ' HB3' ' A' ' 405' ' ' ALA . 71.9 t -126.51 132.12 24.19 Favored Pre-proline 0 C--N 1.327 -0.41 0 C-N-CA 121.096 -0.241 . . . . 0.0 110.415 -172.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.06 111.39 0.89 Allowed 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.705 2.27 . . . . 0.0 111.096 175.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 93.49 17.09 43.53 Favored Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 120.568 -0.825 . . . . 0.0 111.793 -177.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -133.8 -176.17 4.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.815 0.34 . . . . 0.0 111.031 176.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -75.35 127.12 32.43 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.439 -172.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.744 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -145.62 165.72 27.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 172.593 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 136' ' ' PHE . 0.6 OUTLIER -131.19 128.67 40.46 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.719 -0.613 . . . . 0.0 111.822 -178.194 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.462 ' HB2' ' CZ ' ' A' ' 128' ' ' PHE . 1.7 t80 -125.58 101.07 6.73 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 56.2 mt -110.22 103.81 16.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.192 -177.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.7 t30 53.64 38.91 29.38 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.686 0.617 . . . . 0.0 111.262 -178.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.406 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 85.63 21.46 53.64 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.65 -0.786 . . . . 0.0 113.297 177.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -113.76 134.06 54.99 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 117.201 0.501 . . . . 0.0 109.769 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.416 ' HA ' HD23 ' A' ' 135' ' ' LEU . 14.5 mt -88.64 115.25 26.03 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.937 0.399 . . . . 0.0 111.23 -176.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.55 ' HB2' ' HB3' ' A' ' 129' ' ' HIS . 63.9 m-85 -131.09 168.18 17.85 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.554 176.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . 0.654 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 24.9 p -113.78 -169.65 1.55 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.204 0.525 . . . . 0.0 110.854 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.65 -28.97 51.43 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.99 177.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -77.83 -28.28 50.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.493 0.663 . . . . 0.0 109.517 178.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.654 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.4 OUTLIER -67.18 -82.15 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.313 174.657 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 42.46 73.33 0.94 Allowed Pre-proline 0 C--O 1.237 0.438 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.964 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . 0.554 ' O ' ' HB ' ' A' ' 146' ' ' ILE . 50.4 Cg_exo -55.41 100.91 0.08 OUTLIER 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.758 2.305 . . . . 0.0 111.711 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.61 56.49 3.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.825 -173.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -158.72 -78.1 0.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.558 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.505 ' HA ' HD22 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -89.01 71.73 8.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.436 0.636 . . . . 0.0 109.562 175.576 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.554 ' HB ' ' O ' ' A' ' 142' ' ' PRO . 11.5 tt . . . . . 0 C--N 1.321 -0.662 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.234 -176.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.936 0 N-CA-C 112.183 -0.367 . . . . 0.0 112.183 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -113.61 134.19 54.86 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.917 0.389 . . . . 0.0 110.2 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 38.5 mm -79.27 117.99 25.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 176.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 123' ' ' VAL . . . -59.94 132.79 89.61 Favored Pre-proline 0 C--O 1.235 0.34 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.321 -175.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . 0.521 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 2.8 Cg_exo -76.65 -170.81 0.96 Allowed 'Trans proline' 0 N--CA 1.462 -0.364 0 C-N-CA 123.663 2.909 . . . . 0.0 112.414 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -104.73 158.36 32.16 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.269 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . 0.543 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 5.8 Cg_exo -77.62 141.4 19.65 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.778 2.318 . . . . 0.0 112.086 178.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.32 177.28 7.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.291 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -104.28 121.1 42.63 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 178.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -84.8 -102.94 0.05 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.219 -178.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -131.74 130.89 22.44 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -68.01 145.33 67.27 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.132 1.888 . . . . 0.0 111.658 176.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.857 HG21 ' HB3' ' A' ' 93' ' ' SER . 0.1 OUTLIER -76.19 178.1 6.68 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.055 -176.196 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.301 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.099 178.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.637 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.117 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.717 HD21 ' HB ' ' A' ' 414' ' ' THR . 0.5 OUTLIER -144.76 -179.97 6.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.948 0.404 . . . . 0.0 111.281 -177.847 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -92.15 -60.56 1.82 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.219 177.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.536 ' HA3' ' HA ' ' A' ' 415' ' ' SER . . . -87.19 -1.89 83.82 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.185 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 60.92 93.42 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.342 0.591 . . . . 0.0 111.923 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.47 ' HB2' HG22 ' A' ' 414' ' ' THR . 0.6 OUTLIER -146.31 -76.78 0.19 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.475 178.733 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -148.1 127.05 2.48 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 110.519 -1.033 . . . . 0.0 110.519 177.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -118.69 164.47 15.31 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.851 0.358 . . . . 0.0 111.296 -175.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 27.9 t -63.79 144.3 57.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.237 177.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.54 -8.16 58.47 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.297 -178.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.431 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -111.37 -33.69 6.34 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.08 -0.248 . . . . 0.0 111.148 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.464 ' SG ' ' NZ ' ' A' ' 111' ' ' LYS . 32.0 m -100.03 -79.2 0.5 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.552 0.691 . . . . 0.0 110.272 175.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.637 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 113.28 57.56 0.41 Allowed Glycine 0 N--CA 1.442 -0.958 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.767 -176.267 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -146.65 178.39 8.33 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 177.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.611 ' HA ' HD11 ' A' ' 80' ' ' LEU . 0.1 OUTLIER -76.29 160.48 29.59 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.383 0.611 . . . . 0.0 111.326 -177.524 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.658 HG12 HG11 ' A' ' 100' ' ' VAL . 2.8 mp -118.65 100.3 51.17 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.542 177.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.626 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 6.4 Cg_exo -75.41 167.78 25.93 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 123.238 2.626 . . . . 0.0 112.029 176.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.84 -16.01 60.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.88 -177.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.07 -17.24 29.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.955 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.626 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 12.6 mp0 -100.42 147.82 25.43 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.338 -177.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.403 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 21.9 mt -103.97 141.72 35.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.031 0.443 . . . . 0.0 111.088 -176.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.658 HG11 HG12 ' A' ' 94' ' ' ILE . 0.9 OUTLIER -125.94 147.24 30.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.037 178.121 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.461 ' SD ' ' HA ' ' A' ' 110' ' ' LEU . 0.0 OUTLIER -97.94 112.59 24.46 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.007 0.432 . . . . 0.0 110.308 -179.215 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -82.51 113.12 20.03 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.472 -179.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -100.11 -45.51 5.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.675 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.451 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 4.9 mm-40 -154.76 -137.84 0.07 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.102 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.451 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -75.47 -9.59 84.54 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 120.951 -0.643 . . . . 0.0 112.293 179.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -105.24 160.58 14.98 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 176.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -118.66 139.4 46.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.209 0.528 . . . . 0.0 111.921 -174.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -131.48 168.32 17.84 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 174.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.822 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 73.9 m80 -94.53 -163.92 1.11 Allowed 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.461 ' HA ' ' SD ' ' A' ' 101' ' ' MET . 0.4 OUTLIER -84.03 -20.22 33.09 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.002 0.429 . . . . 0.0 110.977 177.153 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.465 ' HG3' ' SG ' ' A' ' 112' ' ' CYS . 0.0 OUTLIER -89.79 -22.09 22.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.74 -175.263 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.822 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -94.45 -5.46 46.18 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.156 -173.548 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.63 74.54 4.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.358 0.599 . . . . 0.0 109.616 175.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.606 HG22 ' HG2' ' A' ' 121' ' ' ARG . 38.2 p -127.39 147.8 50.27 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.171 -179.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.57 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 7.6 p -71.38 146.58 48.66 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.17 0.509 . . . . 0.0 110.355 177.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.08 -1.79 57.25 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.378 -176.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.35 -51.25 3.69 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -175.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.624 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -119.52 -3.71 10.39 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 111.645 0.239 . . . . 0.0 111.645 -175.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 70.61 38.98 1.2 Allowed 'General case' 0 C--O 1.233 0.221 0 O-C-N 123.847 0.717 . . . . 0.0 110.6 179.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -78.91 128.29 33.11 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.917 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.606 ' HG2' HG22 ' A' ' 114' ' ' THR . 0.2 OUTLIER -78.64 109.08 12.52 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 178.468 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.523 HD22 ' HB2' ' A' ' 128' ' ' PHE . 6.4 mt -67.73 148.59 51.08 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.914 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -136.8 140.28 31.37 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.214 -170.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.718 ' HB3' ' HA ' ' A' ' 407' ' ' PHE . 13.5 Cg_endo -55.77 111.42 0.76 Allowed 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.943 2.428 . . . . 0.0 111.887 178.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 108.06 -15.47 36.65 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.311 -176.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -97.55 -179.24 4.4 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.814 ' HD3' ' HG3' ' A' ' 138' ' ' GLU . 0.1 OUTLIER -101.77 143.11 32.1 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.055 0.455 . . . . 0.0 111.462 -171.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.523 ' HB2' HD22 ' A' ' 122' ' ' LEU . 1.4 p90 -149.72 151.46 33.69 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.748 176.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . 0.637 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 59.9 m-70 -113.29 118.51 34.83 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.033 0.444 . . . . 0.0 110.88 -177.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' A' ' 134' ' ' SER . 23.5 t80 -108.36 101.35 10.55 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.879 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.473 HG21 ' O ' ' A' ' 145' ' ' LEU . 2.6 mt -130.64 132.41 64.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.771 179.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 55.7 t30 55.38 35.76 25.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.407 0.622 . . . . 0.0 110.449 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.407 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 67.36 35.93 88.33 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.809 178.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.482 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 4.3 m -131.27 151.18 51.74 Favored 'General case' 0 CA--C 1.517 -0.318 0 O-C-N 122.677 -0.308 . . . . 0.0 110.294 -177.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.7 mt -101.94 121.32 41.91 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.714 -177.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.637 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 59.7 m-85 -126.51 172.27 10.36 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 175.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 8.9 p -125.24 177.49 6.1 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.727 0.298 . . . . 0.0 110.774 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.814 ' HG3' ' HD3' ' A' ' 127' ' ' ARG . 8.8 mm-40 -77.92 -13.52 59.86 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.013 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -78.14 -33.45 50.38 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.624 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 2.7 p30 -91.92 -48.08 6.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.279 176.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . 0.452 HH11 ' HD2' ' A' ' 141' ' ' ARG . 0.0 OUTLIER 43.64 88.23 0.1 Allowed Pre-proline 0 N--CA 1.466 0.331 0 C-N-CA 124.118 0.967 . . . . 0.0 112.993 175.313 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -72.25 72.8 2.77 Favored 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 122.971 2.447 . . . . 0.0 112.041 178.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.41 55.81 0.82 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.469 0.652 . . . . 0.0 111.789 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -147.87 -56.75 0.23 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 175.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.473 ' O ' HG21 ' A' ' 131' ' ' ILE . 0.2 OUTLIER -90.34 71.87 7.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.78 174.721 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.324 -0.5 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.346 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.555 0 N-CA-C 111.882 -0.487 . . . . 0.0 111.882 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.48 155.91 20.34 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 47.7 mm -110.0 134.97 50.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.466 -178.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -68.98 121.81 82.93 Favored Pre-proline 0 C--N 1.328 -0.348 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 175.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -57.54 -90.99 0.0 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.125 2.55 . . . . 0.0 112.905 -175.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . 0.718 ' HA ' ' HB3' ' A' ' 124' ' ' PRO . 0.2 OUTLIER -171.78 150.9 2.68 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -178.833 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . 0.605 ' HD2' ' CD1' ' A' ' 407' ' ' PHE . 47.8 Cg_endo -72.7 111.25 3.2 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 121.761 1.64 . . . . 0.0 110.723 168.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -120.38 170.36 9.44 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.358 -173.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -92.1 109.96 21.32 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 176.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -84.11 -94.09 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.216 -176.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.408 ' HA ' ' HD2' ' A' ' 413' ' ' PRO . 0.3 OUTLIER -131.24 126.32 21.37 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.895 -177.175 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 412' ' ' LEU . 21.8 Cg_endo -62.99 125.03 15.04 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.613 2.209 . . . . 0.0 111.292 173.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.717 ' HB ' HD21 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -107.42 162.35 14.0 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.039 -176.06 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . 0.536 ' HA ' ' HA3' ' A' ' 82' ' ' GLY . 14.1 m . . . . . 0 C--O 1.235 0.291 0 O-C-N 123.568 0.542 . . . . 0.0 110.686 -178.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.516 -0.344 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.681 HD12 ' HA ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -96.16 112.98 24.55 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.213 -173.094 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -61.05 -38.75 87.28 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.705 0.764 . . . . 0.0 109.179 175.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -100.83 111.79 4.24 Favored Glycine 0 N--CA 1.441 -0.974 0 N-CA-C 109.855 -1.298 . . . . 0.0 109.855 168.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.681 ' HA ' HD12 ' A' ' 80' ' ' LEU . 0.8 OUTLIER -71.68 12.72 0.33 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -170.051 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.602 ' HB2' ' HB3' ' A' ' 412' ' ' LEU . 0.1 OUTLIER -82.0 -37.12 27.07 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.604 0.24 . . . . 0.0 110.869 178.269 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 176.67 170.11 38.82 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.927 -0.654 . . . . 0.0 111.859 -177.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.508 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -162.45 171.36 17.23 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.946 0.373 . . . . 0.0 110.814 -178.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.526 ' HB2' ' CE1' ' A' ' 109' ' ' HIS . 42.1 t -73.16 145.86 46.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.911 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.13 -6.96 59.49 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.997 0.427 . . . . 0.0 110.505 175.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -113.04 -49.89 2.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.067 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 26.9 m -84.4 -28.08 27.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.049 0.452 . . . . 0.0 110.604 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.97 25.9 75.01 Favored Glycine 0 N--CA 1.451 -0.341 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.947 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -115.38 142.08 47.17 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.491 -0.188 . . . . 0.0 110.491 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.7 m -65.55 157.74 28.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.143 176.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.72 ' O ' ' HA ' ' A' ' 413' ' ' PRO . 3.4 mp -113.12 116.69 46.74 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.477 -172.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.455 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 6.2 Cg_exo -75.52 165.95 29.52 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.925 2.417 . . . . 0.0 111.192 171.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.72 -16.65 61.66 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.34 0.59 . . . . 0.0 110.505 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.18 -14.77 59.32 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.093 177.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.455 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -109.64 159.57 17.01 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.184 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.3 mt -120.97 146.8 46.29 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.511 0.672 . . . . 0.0 110.931 -176.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.746 HG21 ' HB2' ' A' ' 411' ' ' ALA . 13.9 m -119.76 179.28 2.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.96 -178.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.1 mmt -134.09 122.38 22.84 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 174.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.4 105.38 12.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.049 0.452 . . . . 0.0 110.973 -175.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.402 ' HB2' ' HE1' ' A' ' 113' ' ' PHE . . . -88.25 66.75 8.55 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.866 179.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 55.7 47.36 20.69 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.368 178.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 130.74 -59.63 0.69 Allowed Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.407 178.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -89.99 170.31 10.47 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.886 -0.185 . . . . 0.0 110.553 -178.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -127.33 134.01 66.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.515 0.674 . . . . 0.0 112.42 -174.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -116.79 179.13 4.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 169.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.878 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 72.8 m80 -94.99 -164.29 1.15 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 176.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.6 tp -79.16 -23.03 44.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.949 0.404 . . . . 0.0 110.9 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.437 ' HG2' ' H ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.35 -38.29 13.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.253 0.549 . . . . 0.0 111.35 -176.759 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.878 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.26 -17.66 59.37 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.388 -175.472 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . 0.402 ' HE1' ' HB2' ' A' ' 103' ' ' ALA . 0.1 OUTLIER -72.16 77.02 0.96 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.592 0.711 . . . . 0.0 110.327 176.883 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.752 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.9 OUTLIER -145.6 164.05 32.9 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.083 -177.224 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.501 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 19.9 p -77.97 152.56 33.08 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 120.25 -0.58 . . . . 0.0 109.858 176.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.9 5.61 50.72 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.236 0.541 . . . . 0.0 110.722 -179.127 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.1 -50.77 3.55 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.804 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.94 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -113.53 -13.06 12.82 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.701 0.286 . . . . 0.0 111.064 178.183 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.501 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 65.45 39.36 5.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.38 -177.602 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -86.44 133.16 33.79 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 176.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.752 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.0 OUTLIER -70.32 109.77 4.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.33 -179.01 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.566 HD13 ' HB2' ' A' ' 128' ' ' PHE . 19.8 mt -63.9 149.95 46.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.415 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.55 ' HB ' ' CB ' ' A' ' 126' ' ' ASP . 21.6 t -110.23 130.75 22.52 Favored Pre-proline 0 C--N 1.321 -0.636 0 C-N-CA 120.314 -0.554 . . . . 0.0 110.962 -167.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.48 ' HB3' ' HA ' ' A' ' 407' ' ' PHE . 17.9 Cg_endo -58.93 111.5 0.91 Allowed 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.843 2.362 . . . . 0.0 111.046 174.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 92.6 13.75 56.44 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.23 -177.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.55 ' CB ' ' HB ' ' A' ' 123' ' ' VAL . 1.4 t70 -133.09 -172.93 3.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.599 0.238 . . . . 0.0 110.755 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.21 136.55 57.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.059 -0.518 . . . . 0.0 112.31 -174.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.566 ' HB2' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -157.13 144.97 19.1 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.359 -0.837 . . . . 0.0 108.852 172.85 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . 0.546 ' O ' ' HA ' ' A' ' 135' ' ' LEU . 66.0 m-70 -118.6 125.99 50.98 Favored 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.752 -178.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.477 ' HB2' ' CE2' ' A' ' 128' ' ' PHE . 83.7 t80 -125.4 101.3 6.88 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -128.84 120.45 52.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.343 -177.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.5 t30 59.92 32.75 21.34 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.135 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 74.63 33.29 56.14 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.671 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -133.99 131.76 39.32 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.546 ' HA ' ' O ' ' A' ' 129' ' ' HIS . 6.1 mp -98.93 133.98 42.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.501 -176.424 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.447 ' HA ' ' CB ' ' A' ' 115' ' ' CYS . 21.0 m-85 -136.85 166.03 24.58 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.544 178.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 16.4 p -109.27 -168.45 1.34 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.913 0.387 . . . . 0.0 110.839 178.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -77.64 -26.71 50.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.472 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -73.55 -42.31 61.85 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.563 -175.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.94 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 0.6 OUTLIER -101.19 -2.17 32.0 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.469 -176.59 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 141' ' ' ARG . 32.0 ttt-85 -29.69 105.61 0.22 Allowed Pre-proline 0 N--CA 1.478 0.931 0 O-C-N 124.517 1.136 . . . . 0.0 113.336 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -79.06 88.78 1.42 Allowed 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 123.242 2.628 . . . . 0.0 112.301 178.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.52 -30.67 61.12 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.485 -0.779 . . . . 0.0 112.708 -176.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -75.08 -15.77 60.6 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -175.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 145' ' ' LEU . 1.0 OUTLIER -91.87 -22.39 20.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.818 0.342 . . . . 0.0 111.222 -175.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.561 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.562 -177.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . 0.414 ' HA3' ' CE1' ' A' ' 129' ' ' HIS . . . . . . . . 0 N--CA 1.447 -0.629 0 N-CA-C 111.066 -0.814 . . . . 0.0 111.066 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -116.2 169.52 9.22 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 173.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 50.9 mm -114.44 126.13 71.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 123' ' ' VAL . . . -66.87 134.87 94.09 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.909 -177.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 20.0 Cg_exo -67.01 -176.19 0.73 Allowed 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 123.082 2.521 . . . . 0.0 111.715 176.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . 0.48 ' HA ' ' HB3' ' A' ' 124' ' ' PRO . 27.6 m-85 -107.94 163.46 16.91 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.942 -179.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -54.35 116.78 3.3 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.551 2.167 . . . . 0.0 111.704 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.7 177.53 4.64 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.123 -176.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -116.6 121.81 42.79 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 174.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . 0.746 ' HB2' HG21 ' A' ' 100' ' ' VAL . . . -90.88 -141.35 0.17 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.875 0.369 . . . . 0.0 111.244 -176.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.602 ' HB3' ' HB2' ' A' ' 84' ' ' SER . 0.0 OUTLIER -90.96 113.25 57.49 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.136 -179.41 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . 0.72 ' HA ' ' O ' ' A' ' 94' ' ' ILE . 14.6 Cg_endo -57.77 151.04 58.59 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.997 2.465 . . . . 0.0 113.173 -178.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 3.2 m -71.17 129.82 39.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.265 -178.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.451 -0.386 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 174.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.515 -0.395 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.587 HD23 ' H ' ' A' ' 80' ' ' LEU . 1.3 pt? -96.2 28.98 2.98 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.195 176.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.404 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.3 OUTLIER 52.64 74.69 0.27 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.99 -179.76 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 92.56 -125.63 8.21 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.222 -173.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.551 ' HA ' HD11 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -162.02 66.78 0.25 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.234 0.54 . . . . 0.0 110.4 178.914 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.38 -72.47 0.7 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.046 178.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -141.7 142.87 12.34 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 121.186 -0.531 . . . . 0.0 111.916 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -137.67 158.86 43.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.969 0.414 . . . . 0.0 110.91 -178.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.506 ' HB2' ' CE1' ' A' ' 109' ' ' HIS . 38.0 t -85.89 144.92 27.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.349 177.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.32 -4.0 58.6 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.882 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.422 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -117.11 -47.59 2.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.488 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 57.0 m -82.6 -40.64 20.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.852 0.358 . . . . 0.0 111.276 -179.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 85.57 9.16 79.23 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 110.814 -0.915 . . . . 0.0 110.814 -172.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.493 ' NE2' ' H ' ' A' ' 93' ' ' SER . 0.0 OUTLIER -93.88 164.7 13.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.366 -0.417 . . . . 0.0 109.953 179.213 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.493 ' H ' ' NE2' ' A' ' 92' ' ' GLN . 0.0 OUTLIER -82.03 171.28 14.57 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.059 0.457 . . . . 0.0 111.218 -179.831 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.763 HG12 HG11 ' A' ' 100' ' ' VAL . 2.6 mp -114.77 105.31 53.48 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.372 175.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -73.8 159.12 45.87 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.767 2.311 . . . . 0.0 112.076 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.52 ' HB2' ' HB3' ' A' ' 413' ' ' PRO . . . -71.91 -13.08 61.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.975 0.416 . . . . 0.0 111.118 -178.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.74 12.26 32.62 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.926 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -123.2 157.04 33.91 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.221 0.534 . . . . 0.0 110.718 -179.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.6 mt -114.68 130.03 56.76 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.314 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.763 HG11 HG12 ' A' ' 94' ' ' ILE . 13.2 m -129.66 168.06 23.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.773 -175.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -112.11 141.13 46.18 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.022 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.2 136.35 49.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.361 -178.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -150.97 121.83 7.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.684 -0.234 . . . . 0.0 110.998 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 70.2 -2.64 2.04 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.162 0.585 . . . . 0.0 111.733 176.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 115.83 -16.09 16.29 Favored Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -175.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -89.97 163.92 14.76 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -124.4 140.21 48.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.034 0.445 . . . . 0.0 111.669 -177.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . 0.549 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 98.2 m-85 -131.09 167.49 19.01 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.366 -0.833 . . . . 0.0 108.771 175.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.798 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 72.5 m80 -92.73 -159.14 0.65 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 176.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 5.0 mt -85.29 -22.0 28.75 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.994 0.426 . . . . 0.0 111.37 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.63 -35.61 14.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.939 0.4 . . . . 0.0 111.763 -176.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.798 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.5 -16.66 59.59 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.207 -175.678 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.66 64.53 6.41 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.397 177.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.684 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.6 OUTLIER -131.14 152.47 50.4 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.774 -179.67 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.472 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 5.0 t -64.23 132.21 49.63 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 175.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 3.4 m -82.27 2.47 31.83 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.548 -176.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -106.03 -49.38 3.39 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -176.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.527 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 28.2 p -112.04 -14.42 13.45 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.055 0.455 . . . . 0.0 110.654 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.472 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 73.8 23.81 2.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.287 -179.034 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . 0.527 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 3.2 m-80 -65.88 133.63 51.33 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 170.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.684 ' HA ' HG22 ' A' ' 114' ' ' THR . 10.7 tpp85 -75.29 119.55 19.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.243 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.638 HD11 ' HB3' ' A' ' 135' ' ' LEU . 23.6 mt -58.89 137.19 57.93 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -115.27 132.38 23.09 Favored Pre-proline 0 C--N 1.321 -0.641 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.309 -165.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.47 ' HB2' ' CE2' ' A' ' 407' ' ' PHE . 19.9 Cg_endo -60.63 111.7 1.12 Allowed 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.628 2.219 . . . . 0.0 110.992 175.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 110.29 -4.48 29.89 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.604 -0.807 . . . . 0.0 112.045 -178.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.404 ' O ' ' HA ' ' A' ' 404' ' ' ILE . 1.0 OUTLIER -124.45 -177.76 3.9 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 177.203 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.521 ' HD2' ' HG3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -90.5 149.71 22.09 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.385 0.612 . . . . 0.0 112.348 -172.176 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.531 ' HB2' HD22 ' A' ' 122' ' ' LEU . 5.8 p90 -144.91 147.19 32.47 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.946 -1.025 . . . . 0.0 108.577 172.05 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -112.73 113.75 26.0 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.12 0.486 . . . . 0.0 110.973 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.488 ' CE2' ' HA2' ' A' ' 133' ' ' GLY . 3.8 t80 -92.66 101.1 13.5 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 175.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 28.1 mm -112.56 115.06 48.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.937 -176.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.5 t30 54.41 35.72 23.79 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 123.657 0.598 . . . . 0.0 111.288 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.488 ' HA2' ' CE2' ' A' ' 130' ' ' TYR . . . 80.24 30.11 42.88 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.938 177.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.417 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 0.7 OUTLIER -133.92 146.64 50.7 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.733 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.638 ' HB3' HD11 ' A' ' 122' ' ' LEU . 3.1 mt -95.37 118.98 33.08 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.865 0.364 . . . . 0.0 110.848 -177.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.417 ' CE2' ' HB2' ' A' ' 134' ' ' SER . 69.0 m-85 -126.85 159.66 33.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.939 176.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . 0.526 ' SG ' ' HB2' ' A' ' 140' ' ' ASP . 14.4 p -101.02 169.91 8.63 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.442 -178.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.521 ' HG3' ' HD2' ' A' ' 127' ' ' ARG . 1.5 mm-40 -77.9 -17.7 56.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.267 0.556 . . . . 0.0 110.264 174.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -20.76 58.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.622 0.725 . . . . 0.0 109.222 179.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.526 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 0.4 OUTLIER -104.07 -67.86 0.88 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.995 178.567 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 52.51 89.66 0.1 OUTLIER Pre-proline 0 N--CA 1.466 0.355 0 C-N-CA 123.468 0.707 . . . . 0.0 112.376 178.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -58.19 99.42 0.1 OUTLIER 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.047 2.498 . . . . 0.0 112.405 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.83 -26.64 63.37 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.96 -176.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.69 -39.84 95.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.774 -177.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.2 mt -152.28 90.87 1.54 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.501 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.476 ' H ' HG13 ' A' ' 146' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.956 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.952 0 N-CA-C 112.73 -0.148 . . . . 0.0 112.73 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -76.01 118.05 18.36 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 173.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . 0.404 ' HA ' ' O ' ' A' ' 126' ' ' ASP . 30.2 mm -81.54 138.95 18.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.938 -174.338 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -57.9 128.72 81.22 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.391 176.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . 0.606 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 38.1 Cg_endo -66.98 -5.46 13.56 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.383 2.722 . . . . 0.0 113.93 -174.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . 0.606 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 21.0 m-85 78.06 156.59 0.14 Allowed Pre-proline 0 N--CA 1.468 0.434 0 O-C-N 124.011 0.819 . . . . 0.0 109.935 -178.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.95 128.56 10.06 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.42 2.08 . . . . 0.0 112.203 176.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -140.44 177.21 8.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.585 176.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -86.29 125.63 33.74 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.784 0.326 . . . . 0.0 110.871 -179.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -91.92 -143.03 0.19 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.165 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 13.3 mt -85.35 116.55 66.01 Favored Pre-proline 0 N--CA 1.452 -0.369 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 177.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . 0.52 ' HB3' ' HB2' ' A' ' 96' ' ' ALA . 24.6 Cg_exo -63.75 154.82 67.18 Favored 'Trans proline' 0 C--O 1.237 0.453 0 C-N-CA 122.818 2.346 . . . . 0.0 112.84 -178.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.404 HG21 ' HB3' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -69.25 154.61 41.76 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.259 179.775 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.174 179.569 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.456 ' HB3' ' HB1' ' A' ' 86' ' ' ALA . 0.3 OUTLIER . . . . . 0 C--O 1.233 0.202 0 CA-C-O 121.534 0.683 . . . . 0.0 110.015 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.842 HD13 ' HA ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -121.56 113.71 20.17 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.607 -172.627 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -61.2 -35.56 77.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.32 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -124.3 26.43 5.79 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.149 -0.548 . . . . 0.0 111.963 179.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.842 ' HA ' HD13 ' A' ' 80' ' ' LEU . 2.7 t-20 69.41 161.73 0.21 Allowed 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.509 0.724 . . . . 0.0 112.801 178.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.447 ' N ' HD22 ' A' ' 80' ' ' LEU . 51.4 m 71.76 -61.15 0.5 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.008 -0.996 . . . . 0.0 113.46 174.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -89.23 122.2 6.36 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.547 -0.835 . . . . 0.0 113.22 -174.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.517 ' HA ' ' HA ' ' A' ' 93' ' ' SER . . . -168.29 133.42 1.76 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.578 0.228 . . . . 0.0 111.127 177.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.33 133.57 34.04 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 171.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.7 m -86.66 8.66 21.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.052 -0.522 . . . . 0.0 112.229 -172.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.722 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -98.17 -59.53 1.74 Allowed 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.082 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 26.1 p -86.42 -60.08 2.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.254 0.549 . . . . 0.0 110.609 -177.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.44 ' HA2' ' HE ' ' A' ' 79' ' ' ARG . . . 133.07 -2.8 4.79 Favored Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.739 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -82.19 122.24 27.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.902 0.382 . . . . 0.0 110.279 178.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.582 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.9 OUTLIER -63.13 128.03 33.96 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.809 172.833 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.442 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 1.7 mt -65.31 119.66 61.17 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.789 -174.266 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 94' ' ' ILE . 2.9 Cg_exo -76.88 166.9 26.17 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.25 2.633 . . . . 0.0 111.817 176.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.42 0.85 18.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.931 0.396 . . . . 0.0 111.499 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.18 21.39 14.22 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.875 179.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -135.88 160.31 38.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.739 179.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.1 mp -120.86 150.55 40.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.336 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.9 157.4 42.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.939 -178.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.0 126.78 52.6 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.078 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 102' ' ' ARG . 10.1 mtt-85 -91.48 97.77 11.27 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.412 ' HB2' ' CE1' ' A' ' 113' ' ' PHE . . . -64.68 -59.07 4.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.752 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.3 91.12 0.37 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.004 179.163 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 82.09 -52.69 4.66 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.012 -0.613 . . . . 0.0 112.292 -176.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -90.97 158.66 16.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.586 0.231 . . . . 0.0 111.285 -178.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -118.09 144.24 26.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.9 0.381 . . . . 0.0 111.072 -177.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -137.0 163.74 30.01 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.672 177.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.784 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 12.4 m80 -79.49 170.82 16.01 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.824 0.345 . . . . 0.0 110.773 -179.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.38 -31.61 72.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.821 177.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.535 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.48 -30.83 18.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.122 0.487 . . . . 0.0 110.551 178.609 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.784 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 34.0 m -79.0 -13.74 59.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.148 -178.131 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . 0.412 ' CE1' ' HB2' ' A' ' 103' ' ' ALA . 0.0 OUTLIER -76.18 76.03 3.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.091 174.053 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.576 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.7 OUTLIER -133.79 149.7 51.42 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.115 -178.425 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.444 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 5.5 p -74.53 155.16 38.22 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.142 0.496 . . . . 0.0 111.174 -179.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 1.5 m -79.68 -45.68 18.53 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.248 -175.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.74 -51.57 39.93 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -171.222 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.79 -14.65 16.53 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 121.051 -0.259 . . . . 0.0 111.196 -175.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.444 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 69.41 31.65 3.74 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.88 -176.819 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . 0.414 HD22 ' HB2' ' A' ' 137' ' ' CYS . 22.9 t30 -83.4 146.96 28.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.639 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.576 ' HA ' HG22 ' A' ' 114' ' ' THR . 9.0 ttt180 -85.84 135.47 33.7 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.879 0.371 . . . . 0.0 111.313 -175.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.732 HD22 ' HB2' ' A' ' 128' ' ' PHE . 9.0 mt -81.75 125.71 30.96 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 38.6 t -122.56 138.38 29.21 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.621 -170.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.43 111.41 0.93 Allowed 'Trans proline' 0 N--CA 1.463 -0.277 0 C-N-CA 122.406 2.07 . . . . 0.0 111.072 174.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 114.34 -21.36 15.06 Favored Glycine 0 N--CA 1.446 -0.641 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 -173.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.47 176.02 5.49 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.746 ' HB2' ' HB2' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -102.46 135.83 43.38 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.703 0.287 . . . . 0.0 111.363 -173.807 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.732 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -132.52 159.6 38.95 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.027 179.322 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . 0.564 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 78.1 m-70 -130.09 140.58 50.8 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.774 0.321 . . . . 0.0 110.528 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.422 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 10.7 t80 -125.28 101.98 7.23 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 178.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 7.6 mt -121.84 111.33 30.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 120.732 0.301 . . . . 0.0 110.649 -176.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 51.7 t30 57.87 51.13 9.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.667 179.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.422 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 62.19 35.58 91.74 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.736 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 2.6 m -133.38 138.85 46.48 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -177.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 24.3 mt -92.67 125.34 37.25 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.975 -175.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.564 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 76.5 m-85 -129.43 161.96 29.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.055 176.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . 0.513 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 17.1 p -111.07 -176.14 2.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.953 0.406 . . . . 0.0 111.298 -175.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.746 ' HB2' ' HB2' ' A' ' 127' ' ' ARG . 0.0 OUTLIER -71.56 -32.94 68.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.871 176.661 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -68.11 -34.42 76.34 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 177.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.513 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.7 OUTLIER -66.35 -77.73 0.06 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.271 175.47 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 44.18 70.59 1.83 Allowed Pre-proline 0 CA--C 1.529 0.15 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.855 -176.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . 0.4 ' O ' HG22 ' A' ' 146' ' ' ILE . 8.9 Cg_exo -72.09 78.66 1.81 Allowed 'Trans proline' 0 C--O 1.236 0.394 0 C-N-CA 122.762 2.308 . . . . 0.0 111.786 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 18.4 m -57.79 -41.2 81.63 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.993 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -71.62 -24.28 61.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.945 0.402 . . . . 0.0 111.45 -177.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -79.79 -52.66 7.64 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.1 -178.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.426 ' O ' HG13 ' A' ' 146' ' ' ILE . 0.8 OUTLIER . . . . . 0 C--N 1.325 -0.494 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.728 -175.526 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.615 0 N-CA-C 111.98 -0.448 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.48 144.91 28.42 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.866 0.365 . . . . 0.0 110.811 -178.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 28.4 mm -79.43 141.74 14.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 177.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . 0.462 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -50.25 127.06 22.24 Favored Pre-proline 0 N--CA 1.462 0.128 0 O-C-N 123.289 0.368 . . . . 0.0 111.025 177.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 15.3 Cg_exo -69.45 10.29 0.46 Allowed 'Trans proline' 0 N--CA 1.475 0.44 0 C-N-CA 123.733 2.956 . . . . 0.0 114.023 -171.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 15.1 m-85 70.34 158.54 0.16 Allowed Pre-proline 0 N--CA 1.466 0.355 0 O-C-N 123.554 0.534 . . . . 0.0 111.741 176.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -83.89 149.38 12.4 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.647 2.232 . . . . 0.0 112.915 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -155.13 160.74 41.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.441 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -78.19 124.59 28.25 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 176.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -94.45 -139.48 0.23 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.288 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.1 OUTLIER -91.45 111.79 50.86 Favored Pre-proline 0 C--N 1.329 -0.286 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 175.396 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 28.8 Cg_exo -61.75 132.18 38.88 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.512 2.141 . . . . 0.0 112.16 -179.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.582 HG21 ' HB3' ' A' ' 93' ' ' SER . 1.0 OUTLIER -70.64 139.03 51.22 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.407 -179.22 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.469 0.517 0 C-N-CA 123.777 0.831 . . . . 0.0 111.845 177.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.0 ttt85 . . . . . 0 CA--C 1.521 -0.148 0 CA-C-O 121.31 0.576 . . . . 0.0 109.793 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.719 HD21 ' HA ' ' A' ' 83' ' ' ASN . 0.4 OUTLIER -154.76 -176.72 6.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.116 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -82.26 72.04 9.32 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.54 0.686 . . . . 0.0 110.067 176.52 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 125.29 -117.65 3.03 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.413 -178.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.719 ' HA ' HD21 ' A' ' 80' ' ' LEU . 1.4 t-20 -159.32 175.49 13.31 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 178.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 10.5 m 62.09 73.29 0.47 Allowed 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.88 0.737 . . . . 0.0 112.04 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . 0.505 ' HA3' HG22 ' A' ' 414' ' ' THR . . . 128.59 83.41 0.37 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.191 -1.004 . . . . 0.0 112.978 175.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.563 ' HB2' HD22 ' A' ' 80' ' ' LEU . . . -148.25 144.37 27.61 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.629 -0.336 . . . . 0.0 110.181 178.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 4.7 t -66.65 142.62 57.39 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.693 177.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.585 ' HB2' ' CE1' ' A' ' 108' ' ' TYR . 0.7 OUTLIER -95.13 8.37 43.21 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.677 174.637 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.706 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -118.42 -59.7 1.86 Allowed 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.622 -179.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.431 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 31.1 p -91.09 -73.97 0.52 Allowed 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.167 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.431 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 129.56 61.02 0.1 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.548 176.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.511 ' NE2' ' HA ' ' A' ' 92' ' ' GLN . 0.5 OUTLIER -137.52 150.51 47.58 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.6 0.238 . . . . 0.0 110.374 178.612 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.0 119.71 14.62 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.972 176.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.5 mp -76.54 120.23 80.79 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.785 -174.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.43 ' HD2' ' HB3' ' A' ' 98' ' ' GLU . 5.7 Cg_exo -77.74 166.24 25.69 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.524 2.816 . . . . 0.0 111.778 173.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.23 -21.05 61.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.962 0.411 . . . . 0.0 110.982 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.42 -13.66 58.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.282 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.43 ' HB3' ' HD2' ' A' ' 95' ' ' PRO . 15.1 tt0 -106.38 121.08 43.53 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.038 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 21.2 mt -84.75 139.3 32.07 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.552 -178.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.449 ' O ' ' HA ' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -115.09 144.59 22.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.945 -178.229 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.439 ' SD ' ' HG ' ' A' ' 110' ' ' LEU . 0.0 OUTLIER -91.81 120.26 32.36 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.993 179.965 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.513 ' HD2' HG13 ' A' ' 107' ' ' VAL . 8.3 tpt180 -96.74 108.76 21.46 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.034 -177.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -82.34 -40.22 21.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.055 0.455 . . . . 0.0 110.152 175.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.469 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -174.34 -106.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.582 176.747 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.469 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -76.69 -30.19 56.57 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.603 -0.808 . . . . 0.0 111.719 176.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -89.38 159.48 17.3 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.714 0.292 . . . . 0.0 110.974 -176.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.513 HG13 ' HD2' ' A' ' 102' ' ' ARG . 0.1 OUTLIER -128.99 135.91 60.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.834 -179.738 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . 0.585 ' CE1' ' HB2' ' A' ' 88' ' ' SER . 74.3 m-85 -135.92 164.79 27.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.445 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.843 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 19.4 m80 -92.32 172.33 8.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.537 179.169 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.667 HD21 ' HG3' ' A' ' 408' ' ' PRO . 0.5 OUTLIER -65.15 -30.96 71.92 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.341 0.591 . . . . 0.0 110.665 175.232 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.443 ' HG2' ' H ' ' A' ' 111' ' ' LYS . 2.4 pttt -90.11 -13.51 35.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.85 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.843 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 35.4 m -103.77 -20.76 13.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.126 -173.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . 0.529 ' HD1' ' HA ' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -64.85 98.27 0.27 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.269 177.669 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.595 HG22 ' HA ' ' A' ' 121' ' ' ARG . 2.8 p -147.7 160.88 42.21 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -178.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 9.1 p -83.89 153.18 24.13 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 120.815 0.341 . . . . 0.0 110.296 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.16 -16.12 59.25 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.308 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.76 -51.05 5.71 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -173.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.797 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -112.85 -15.63 12.87 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.771 -0.371 . . . . 0.0 111.322 -178.024 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 67.69 36.31 3.68 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 123.624 0.577 . . . . 0.0 110.161 -176.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -73.81 123.51 24.32 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 175.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.595 ' HA ' HG22 ' A' ' 114' ' ' THR . 1.4 mtm180 -74.78 106.46 6.33 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.884 0.374 . . . . 0.0 110.744 -175.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.625 HD22 ' HB2' ' A' ' 128' ' ' PHE . 2.7 mt -66.1 133.94 51.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.007 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 14.8 t -132.85 142.28 44.13 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.695 -171.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_exo -57.09 109.56 0.47 Allowed 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 121.86 1.706 . . . . 0.0 110.72 173.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 117.39 -13.56 13.63 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.561 -174.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -108.29 169.04 8.88 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 175.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.507 ' HB2' ' HB3' ' A' ' 138' ' ' GLU . 8.6 mtt85 -100.49 145.61 28.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.958 0.409 . . . . 0.0 111.374 -174.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.625 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.4 OUTLIER -148.34 171.94 15.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.883 -179.799 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . 0.556 ' CD2' ' HG3' ' A' ' 141' ' ' ARG . 3.3 m-70 -140.92 139.62 34.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.042 0.449 . . . . 0.0 111.282 178.262 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.624 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 46.6 t80 -124.26 103.24 8.12 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.505 HD12 ' CD2' ' A' ' 136' ' ' PHE . 13.5 mt -115.56 105.35 18.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.258 -175.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 64.4 24.56 13.23 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.033 174.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.624 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 92.94 31.86 8.31 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.614 -179.316 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.14 138.93 45.55 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.481 HD23 ' HD1' ' A' ' 130' ' ' TYR . 21.9 mt -96.94 127.74 43.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.957 0.408 . . . . 0.0 111.643 -176.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.505 ' CD2' HD12 ' A' ' 131' ' ' ILE . 72.9 m-85 -135.0 160.9 36.84 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 173.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . 0.606 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 23.7 p -101.79 -171.76 2.03 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.193 0.521 . . . . 0.0 110.461 179.48 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.507 ' HB3' ' HB2' ' A' ' 127' ' ' ARG . 3.6 pt-20 -77.31 -21.44 53.49 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.176 177.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . 0.606 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 72.7 t60 -82.15 -40.84 21.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.485 -175.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.797 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 0.1 OUTLIER -103.24 9.84 37.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.224 -178.005 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . 0.556 ' HG3' ' CD2' ' A' ' 129' ' ' HIS . 15.1 ttp180 -43.9 110.84 1.03 Allowed Pre-proline 0 N--CA 1.468 0.456 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.217 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 6.3 Cg_exo -78.88 107.07 2.19 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 123.279 2.652 . . . . 0.0 112.2 -178.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 16.0 m -79.29 -20.41 48.09 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.166 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.92 -57.45 8.74 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 121.016 0.436 . . . . 0.0 110.462 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 1.7 mp -116.11 81.69 1.65 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.77 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.411 ' HB ' ' O ' ' A' ' 142' ' ' PRO . 1.4 tt . . . . . 0 C--N 1.322 -0.607 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.299 -174.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.554 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.88 134.86 56.87 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.049 0.452 . . . . 0.0 112.116 -173.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 43.4 mm -66.94 136.56 26.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.623 174.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -52.98 124.95 38.92 Favored Pre-proline 0 C--N 1.331 -0.226 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 176.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . 0.446 ' O ' ' HD1' ' A' ' 407' ' ' PHE . 78.7 Cg_exo -46.31 -82.67 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.576 2.85 . . . . 0.0 113.136 -172.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . 0.629 ' CD2' ' HD2' ' A' ' 408' ' ' PRO . 0.2 OUTLIER 169.8 150.64 0.14 Allowed Pre-proline 0 C--N 1.329 -0.293 0 C-N-CA 123.437 0.695 . . . . 0.0 109.181 177.054 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . 0.667 ' HG3' HD21 ' A' ' 110' ' ' LEU . 87.0 Cg_endo -85.69 129.7 3.61 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.443 2.096 . . . . 0.0 112.606 174.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -139.53 164.04 30.95 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 177.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -74.71 110.87 9.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.679 0.276 . . . . 0.0 110.441 179.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -84.2 -90.78 0.09 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.941 -176.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -131.4 130.79 22.63 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.564 -176.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.18 131.64 35.39 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.843 2.362 . . . . 0.0 111.328 173.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.505 HG22 ' HA3' ' A' ' 85' ' ' GLY . 68.1 p -110.01 169.22 8.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.871 -172.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.533 0.322 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.867 177.166 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 . . . . . 0 N--CA 1.452 -0.337 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.798 HD12 ' H ' ' A' ' 84' ' ' SER . 1.2 pt? -147.82 123.11 10.26 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.911 -1.04 . . . . 0.0 108.934 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -51.83 -60.02 3.65 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 123.622 0.576 . . . . 0.0 110.433 -175.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.72 124.44 8.02 Favored Glycine 0 N--CA 1.44 -1.068 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 168.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -65.01 87.51 0.06 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 117.069 0.434 . . . . 0.0 110.119 -179.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.798 ' H ' HD12 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -148.76 -58.68 0.22 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.402 -178.727 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . 0.43 ' H ' HG23 ' A' ' 414' ' ' THR . . . -150.57 163.29 29.57 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 121.035 -0.602 . . . . 0.0 111.858 179.149 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.634 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -167.11 162.19 15.15 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.95 143.92 26.09 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.99 14.44 6.16 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -172.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.614 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -112.01 -58.23 2.16 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 121.055 -0.258 . . . . 0.0 111.28 179.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.529 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 32.0 p -95.32 -72.85 0.61 Allowed 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.47 -175.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.529 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 130.65 6.78 3.62 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 111.751 -0.54 . . . . 0.0 111.751 -176.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -83.99 117.81 23.63 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 174.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.762 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.7 OUTLIER -62.59 124.28 20.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.703 -177.745 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.4 mt -64.85 111.33 5.57 Favored Pre-proline 0 C--N 1.329 -0.312 0 O-C-N 123.685 0.616 . . . . 0.0 112.119 -171.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.563 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 8.0 Cg_exo -73.63 168.15 25.49 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 123.064 2.509 . . . . 0.0 111.111 173.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.87 -0.49 11.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.868 0.366 . . . . 0.0 111.346 -178.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -116.59 13.25 15.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.009 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.563 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.6 OUTLIER -115.62 142.86 46.17 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.458 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.3 mp -109.64 138.74 45.56 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.291 -177.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -120.21 146.96 24.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.558 -178.166 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.489 ' SD ' ' HG3' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -94.98 113.01 24.67 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.864 179.434 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.51 ' H ' ' HG3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -91.25 102.68 15.39 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.721 -177.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -78.93 -35.26 43.61 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.299 0.571 . . . . 0.0 110.163 176.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -148.98 -128.72 0.05 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.323 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -91.19 10.07 75.91 Favored Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 110.988 -0.845 . . . . 0.0 110.988 172.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -120.14 143.81 48.0 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.188 -0.506 . . . . 0.0 109.837 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -113.72 140.8 32.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.296 0.57 . . . . 0.0 112.411 -173.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -131.37 160.69 34.31 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 172.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.849 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 21.7 m80 -83.05 170.39 14.9 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.823 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.464 ' HA ' ' SD ' ' A' ' 101' ' ' MET . 1.7 tp -66.96 -29.35 69.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.289 0.566 . . . . 0.0 109.9 174.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -89.24 -11.18 44.35 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.441 177.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.849 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 34.4 m -108.34 0.17 21.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.049 -176.197 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . 0.467 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.0 OUTLIER -86.04 59.99 5.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.373 0.606 . . . . 0.0 110.3 178.064 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.9 p -114.22 155.5 26.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.204 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.503 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 17.1 p -68.99 153.62 43.49 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.174 0.512 . . . . 0.0 110.487 177.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.79 7.44 30.44 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.483 -176.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.48 -51.09 2.82 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -176.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -115.31 -4.52 12.38 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.508 -177.064 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.441 HH11 ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 66.13 32.04 8.4 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.105 -177.062 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . 0.426 ' HB3' ' HB3' ' A' ' 137' ' ' CYS . 58.2 t30 -79.45 124.17 28.22 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.347 177.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.432 ' HE ' ' HB3' ' A' ' 121' ' ' ARG . 1.5 ttp180 -78.87 121.82 25.32 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.725 0.298 . . . . 0.0 110.633 -178.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.556 HD13 ' HB2' ' A' ' 128' ' ' PHE . 1.9 mt -69.61 162.0 28.5 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.202 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.411 ' HA ' ' HD3' ' A' ' 124' ' ' PRO . 75.8 t -128.64 130.34 23.5 Favored Pre-proline 0 C--N 1.328 -0.331 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.685 -174.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 123' ' ' VAL . 36.3 Cg_exo -61.69 111.28 1.14 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.578 2.185 . . . . 0.0 110.81 174.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.11 -18.66 14.03 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.525 -176.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.471 ' O ' ' HA ' ' A' ' 404' ' ' ILE . 2.0 t70 -112.78 -168.91 1.38 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 177.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.45 ' HA ' ' O ' ' A' ' 208' ' ' SER . 0.0 OUTLIER -90.76 147.14 23.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.473 0.654 . . . . 0.0 112.246 -171.441 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.556 ' HB2' HD13 ' A' ' 122' ' ' LEU . 0.4 OUTLIER -145.33 159.77 42.54 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.711 -1.132 . . . . 0.0 108.566 175.274 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 11.2 m-70 -126.62 122.48 35.14 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.104 0.478 . . . . 0.0 111.299 -178.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.439 ' CE2' ' HA2' ' A' ' 133' ' ' GLY . 11.0 t80 -124.97 101.27 6.97 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 173.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 12.3 mt -124.54 124.18 67.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.464 -176.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 60.9 29.47 19.03 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.864 178.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.439 ' HA2' ' CE2' ' A' ' 130' ' ' TYR . . . 75.18 35.27 49.41 Favored Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.563 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 15.6 m -137.0 146.29 45.15 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.9 mt -98.79 130.4 45.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.346 0.593 . . . . 0.0 111.698 -174.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.503 ' HA ' ' HB2' ' A' ' 115' ' ' CYS . 40.3 m-85 -130.77 163.44 27.31 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.543 172.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . 0.678 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 31.0 p -106.54 -173.36 2.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.087 0.47 . . . . 0.0 111.366 -175.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.94 -26.43 59.6 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.492 177.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -77.96 -36.43 49.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.591 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.678 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.2 OUTLIER -57.66 -68.32 0.25 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.876 -1.057 . . . . 0.0 111.142 178.035 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 43.16 71.39 1.45 Allowed Pre-proline 0 N--CA 1.465 0.313 0 O-C-N 123.979 0.799 . . . . 0.0 111.389 -177.432 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -49.96 121.73 7.94 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.769 2.313 . . . . 0.0 112.244 -177.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.88 4.12 51.8 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.655 -176.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -104.2 -63.51 1.2 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.795 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -111.76 113.72 26.26 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.819 0.342 . . . . 0.0 110.236 178.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.323 -0.56 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.065 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.54 0 N-CA-C 112.08 -0.408 . . . . 0.0 112.08 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . 0.45 ' O ' ' HA ' ' A' ' 127' ' ' ARG . 0.1 OUTLIER -78.7 165.21 23.88 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 177.422 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . 0.471 ' HA ' ' O ' ' A' ' 126' ' ' ASP . 51.3 mm -87.31 130.84 36.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . 0.446 ' HB2' ' HB3' ' A' ' 128' ' ' PHE . . . -60.56 123.81 75.79 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.92 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . 0.467 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 31.6 Cg_exo -60.22 154.72 50.22 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.967 2.445 . . . . 0.0 112.465 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . 0.454 ' HA ' ' HD3' ' A' ' 408' ' ' PRO . 21.5 m-85 -87.25 148.24 44.32 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.989 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . 0.489 ' HG3' ' SD ' ' A' ' 101' ' ' MET . 9.9 Cg_exo -70.71 138.51 34.94 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.995 2.463 . . . . 0.0 112.089 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -143.14 177.55 8.31 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 177.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -93.53 110.74 22.31 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.861 0.363 . . . . 0.0 110.379 179.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -80.5 -91.9 0.05 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.741 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 14.1 tp -131.08 120.25 18.19 Favored Pre-proline 0 C--N 1.325 -0.458 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 178.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -62.12 121.28 9.25 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.221 1.948 . . . . 0.0 111.259 175.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.762 HG21 ' HB3' ' A' ' 93' ' ' SER . 6.5 m -75.62 153.74 37.09 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.459 -175.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 C--O 1.232 0.164 0 C-N-CA 123.478 0.711 . . . . 0.0 110.957 177.605 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.574 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.3 OUTLIER . . . . . 0 N--CA 1.463 0.222 0 CA-C-O 121.259 0.552 . . . . 0.0 109.827 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.785 HD13 ' HA ' ' A' ' 83' ' ' ASN . 0.1 OUTLIER -145.75 14.41 1.37 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.922 -178.668 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 49.65 -108.61 0.32 Allowed 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.973 -171.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.21 106.58 2.01 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 172.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.785 ' HA ' HD13 ' A' ' 80' ' ' LEU . 0.8 OUTLIER -47.02 113.96 0.76 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 122.795 0.438 . . . . 0.0 111.778 -176.248 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.11 -73.73 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.566 176.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -136.41 127.22 4.07 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.641 -0.79 . . . . 0.0 113.031 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.679 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -149.06 165.25 32.25 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 177.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.33 139.51 39.21 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -20.01 51.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.002 -171.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.801 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -77.79 -43.61 30.1 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.981 -0.288 . . . . 0.0 111.461 -174.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.422 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 26.9 p -103.21 -64.65 1.06 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.137 0.494 . . . . 0.0 110.36 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.574 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 118.11 45.81 0.48 Allowed Glycine 0 N--CA 1.443 -0.892 0 C-N-CA 120.932 -0.651 . . . . 0.0 111.733 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.422 ' NE2' ' H ' ' A' ' 93' ' ' SER . 0.0 OUTLIER -123.42 145.21 48.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.864 0.364 . . . . 0.0 110.261 179.231 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.758 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.0 OUTLIER -67.86 143.03 55.92 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.641 176.766 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.6 mt -111.86 101.84 52.31 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.716 -178.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.38 168.45 22.87 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 123.234 2.623 . . . . 0.0 111.519 173.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.49 4.37 4.92 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -175.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -96.67 -17.94 20.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.297 0.57 . . . . 0.0 110.07 177.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -102.86 153.31 20.31 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.327 -174.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.552 HD23 ' HB2' ' A' ' 408' ' ' PRO . 1.0 OUTLIER -109.67 143.87 38.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.974 0.416 . . . . 0.0 110.921 -176.672 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 162.19 36.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.785 -179.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.49 113.66 23.12 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.972 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -104.68 117.16 33.4 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.647 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -79.27 -59.76 2.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.768 176.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.28 114.25 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.389 176.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.43 -70.14 3.01 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.257 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -89.85 152.73 21.12 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.822 0.344 . . . . 0.0 110.492 -179.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.6 p -119.88 145.5 26.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.345 -177.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -137.99 -175.56 4.14 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.781 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.886 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 26.3 m80 -106.38 -179.72 4.02 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.383 -0.228 . . . . 0.0 110.383 179.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.37 -41.96 88.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.132 0.491 . . . . 0.0 110.187 178.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.676 ' HE2' ' SG ' ' A' ' 112' ' ' CYS . 0.1 OUTLIER -80.02 -28.35 39.36 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.367 179.134 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.886 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 27.6 m -79.64 -16.32 56.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.182 -178.484 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . 0.579 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.0 OUTLIER -76.67 82.15 3.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.251 178.257 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.553 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.0 OUTLIER -136.35 158.24 44.9 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.131 -178.263 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.544 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 3.4 p -72.26 152.19 42.33 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 176.097 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 2.4 m -87.27 5.44 38.3 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -175.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -114.61 -50.63 2.78 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -176.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.753 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -115.11 6.99 15.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.809 0.338 . . . . 0.0 110.495 -177.959 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER 52.13 40.18 28.16 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.266 -179.074 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . 0.759 HD22 ' HB2' ' A' ' 137' ' ' CYS . 40.1 t30 -81.33 130.13 34.91 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.558 178.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.553 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.6 OUTLIER -76.5 123.21 25.69 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.945 -175.918 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.516 HD13 ' HD2' ' A' ' 128' ' ' PHE . 4.6 mt -80.19 138.21 36.82 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.063 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -134.43 139.89 34.11 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.455 -174.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.455 ' HB3' ' CE2' ' A' ' 407' ' ' PHE . 52.8 Cg_exo -54.26 118.95 5.58 Favored 'Trans proline' 0 N--CA 1.463 -0.305 0 C-N-CA 122.575 2.183 . . . . 0.0 111.425 173.417 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 100.27 -0.27 55.89 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.53 -176.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -119.58 -173.35 2.51 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.727 0.299 . . . . 0.0 110.328 177.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -91.88 126.46 36.98 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.984 0.421 . . . . 0.0 111.166 -172.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.516 ' HD2' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -137.08 135.36 37.41 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 174.802 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -124.07 115.98 22.05 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.142 0.496 . . . . 0.0 111.13 -177.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.465 ' HB2' ' CZ ' ' A' ' 128' ' ' PHE . 6.2 t80 -103.47 101.41 11.3 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 178.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 4.6 mt -118.92 115.28 47.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.622 -176.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 3.3 m120 58.9 31.76 21.61 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.375 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.41 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 80.61 34.36 28.47 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.442 -0.885 . . . . 0.0 112.687 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.493 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 0.4 OUTLIER -139.69 140.17 36.78 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 -179.55 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.3 mt -91.1 122.23 33.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.073 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.544 ' HA ' ' HB2' ' A' ' 115' ' ' CYS . 70.6 m-85 -128.74 158.88 37.37 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.622 176.25 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . 0.759 ' HB2' HD22 ' A' ' 120' ' ' ASN . 8.5 p -114.08 -168.97 1.43 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.017 0.437 . . . . 0.0 111.35 -177.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.25 -22.47 48.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.053 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . 0.711 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 37.2 m-70 -78.16 -28.93 48.4 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 120.997 0.427 . . . . 0.0 110.574 -176.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.753 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 0.8 OUTLIER -123.02 29.04 6.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.471 -178.6 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . 0.432 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 45.0 ttt180 -51.55 111.19 2.21 Favored Pre-proline 0 N--CA 1.469 0.521 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.706 -178.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 1.0 OUTLIER -84.81 83.08 1.63 Allowed 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 123.366 2.71 . . . . 0.0 112.17 -178.78 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.8 -1.02 4.71 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -178.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -67.46 -17.34 64.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.799 0.333 . . . . 0.0 111.385 179.212 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.468 ' HB3' ' H ' ' A' ' 146' ' ' ILE . 3.9 tp -143.21 -102.37 0.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.685 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.468 ' H ' ' HB3' ' A' ' 145' ' ' LEU . 56.4 mt . . . . . 0 N--CA 1.465 0.304 0 CA-C-O 121.059 0.457 . . . . 0.0 111.292 -175.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.687 0 N-CA-C 110.974 -0.85 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . 0.477 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 43.9 m -114.83 160.16 19.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.36 0.6 . . . . 0.0 111.311 -179.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 5.4 mm -111.57 138.16 41.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.357 178.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . 0.439 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -58.8 123.87 70.35 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-O 120.909 0.385 . . . . 0.0 111.532 -178.063 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . 0.579 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 31.4 Cg_exo -59.81 161.61 17.98 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.293 2.662 . . . . 0.0 112.491 177.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . 0.455 ' CE2' ' HB3' ' A' ' 124' ' ' PRO . 34.1 m-85 -94.77 156.46 38.19 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.481 -177.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . 0.552 ' HB2' HD23 ' A' ' 99' ' ' LEU . 50.5 Cg_endo -69.3 140.46 44.45 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.895 2.397 . . . . 0.0 112.752 179.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -144.82 175.78 9.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.516 178.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -98.08 109.74 22.44 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 174.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -85.77 -89.35 0.11 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.447 -175.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.482 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 2.1 tp -131.21 128.88 22.26 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.157 -178.021 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 3.2 Cg_exo -75.6 155.41 40.19 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.911 2.407 . . . . 0.0 111.913 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.758 HG21 ' HB3' ' A' ' 93' ' ' SER . 0.2 OUTLIER -83.06 176.5 9.18 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.772 177.055 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.179 177.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.451 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.1 OUTLIER . . . . . 0 CA--C 1.519 -0.227 0 CA-C-O 121.249 0.547 . . . . 0.0 110.329 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.754 HD11 ' H ' ' A' ' 84' ' ' SER . 1.5 pt? -98.86 155.31 17.45 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.597 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -73.22 -78.96 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.849 0.356 . . . . 0.0 111.077 -176.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -77.27 96.58 1.24 Allowed Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.473 -0.87 . . . . 0.0 111.17 175.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.473 ' HA ' HD11 ' A' ' 80' ' ' LEU . 58.4 t30 -56.41 100.69 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.229 0.537 . . . . 0.0 111.865 -174.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.754 ' H ' HD11 ' A' ' 80' ' ' LEU . 4.4 m -153.99 -62.15 0.13 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.708 175.53 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -141.73 118.56 1.34 Allowed Glycine 0 C--N 1.333 0.399 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.735 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.481 ' HB2' HD13 ' A' ' 80' ' ' LEU . . . -135.78 149.25 49.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.761 0.315 . . . . 0.0 110.424 179.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.888 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 3.3 t -57.18 145.93 29.77 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.262 177.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.5 m -99.63 -1.38 38.19 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.861 172.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.699 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -102.22 -59.26 1.73 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.014 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 30.7 p -93.98 -31.6 14.19 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 120.265 -0.574 . . . . 0.0 109.862 176.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.888 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 92.83 14.45 55.05 Favored Glycine 0 N--CA 1.45 -0.394 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.953 172.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -89.69 146.84 24.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.722 0.261 . . . . 0.0 110.759 178.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.464 ' HB2' HG21 ' A' ' 414' ' ' THR . 0.0 OUTLIER -66.08 140.31 58.24 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.457 176.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.7 mt -110.78 119.34 46.44 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -174.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -78.37 155.53 28.66 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.938 2.425 . . . . 0.0 110.628 167.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.797 ' HB2' ' HG3' ' A' ' 413' ' ' PRO . . . -68.07 -15.23 63.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.972 0.415 . . . . 0.0 111.116 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.94 -5.37 53.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.633 178.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -111.43 120.22 41.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.638 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.5 tp -76.1 128.53 35.18 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.968 0.413 . . . . 0.0 110.786 -178.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -116.59 140.02 40.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.335 -179.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.94 112.6 20.3 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.449 ' HD3' ' OE2' ' A' ' 409' ' ' GLU . 0.0 OUTLIER -88.42 150.46 23.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.175 -176.118 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -130.58 -134.78 0.21 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.331 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.73 69.75 3.14 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.093 0.473 . . . . 0.0 110.561 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 85.42 -25.79 6.14 Favored Glycine 0 N--CA 1.452 -0.275 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.435 179.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -89.35 156.14 18.9 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.734 0.302 . . . . 0.0 111.044 -177.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.29 132.59 67.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.791 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . 0.483 ' HD1' ' HB2' ' A' ' 89' ' ' ALA . 44.8 m-85 -128.15 171.28 12.07 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.332 176.412 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.959 ' H ' ' HB2' ' A' ' 112' ' ' CYS . 23.8 m80 -101.36 179.22 4.42 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 177.159 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.7 mt -62.34 -28.61 69.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.227 0.537 . . . . 0.0 110.698 177.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.512 ' HG3' ' H ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.06 -34.37 15.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.289 176.919 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.959 ' HB2' ' H ' ' A' ' 109' ' ' HIS . 4.2 m -78.78 -5.7 54.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.836 -175.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -96.38 66.0 2.37 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 172.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.576 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.5 OUTLIER -119.97 158.03 27.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.76 -178.95 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.559 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 5.6 t -62.61 152.5 34.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.292 173.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.2 m -87.1 -32.89 19.67 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.799 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -99.12 -51.59 3.79 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -174.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.461 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 8.3 p -90.23 -20.33 23.13 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.89 0.376 . . . . 0.0 110.116 178.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.559 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 69.52 25.28 5.4 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.844 175.201 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . 0.461 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 5.1 m-80 -70.1 128.35 35.99 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 174.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.576 ' HA ' HG22 ' A' ' 114' ' ' THR . 9.7 ttp85 -65.64 116.99 7.45 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 176.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 19.9 mt -65.5 151.99 45.07 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.731 0.301 . . . . 0.0 110.345 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 90.7 t -123.47 131.31 24.3 Favored Pre-proline 0 C--N 1.325 -0.466 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.651 -171.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.455 ' HA ' ' HB3' ' A' ' 405' ' ' ALA . 27.0 Cg_endo -65.01 110.43 1.5 Allowed 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 121.814 1.676 . . . . 0.0 110.596 172.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.52 -17.05 14.15 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.415 -173.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -117.33 -161.18 0.8 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.82 150.34 27.9 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -169.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.538 ' O ' ' HB2' ' A' ' 208' ' ' SER . 0.0 OUTLIER -157.62 135.82 11.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.251 172.175 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -126.09 128.59 47.6 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.89 0.376 . . . . 0.0 110.574 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.405 ' HA ' ' O ' ' A' ' 134' ' ' SER . 9.8 t80 -124.81 102.56 7.62 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.836 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.782 HD13 ' HG2' ' A' ' 142' ' ' PRO . 2.6 mp -131.32 130.43 63.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 -179.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.51 32.14 20.42 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 123.463 0.477 . . . . 0.0 110.248 -179.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 64.87 36.09 92.68 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.523 -177.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.405 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.9 OUTLIER -131.62 147.85 52.56 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.464 -0.433 . . . . 0.0 109.884 -179.135 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 13.7 mt -101.26 115.06 29.63 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.322 -174.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -122.16 173.32 7.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.67 174.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . 0.772 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 29.4 p -119.09 -165.93 1.2 Allowed 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 177.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.09 -25.99 47.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.265 0.555 . . . . 0.0 109.51 175.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . 0.772 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 68.4 t60 -74.57 -24.34 58.9 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.256 -0.884 . . . . 0.0 108.738 176.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.535 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 1.7 m-20 -113.8 23.73 12.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.486 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 24.5 ttt-85 -62.88 115.14 15.13 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.125 -175.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . 0.782 ' HG2' HD13 ' A' ' 131' ' ' ILE . 44.9 Cg_exo -56.89 114.87 2.12 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.042 2.494 . . . . 0.0 112.645 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -18.25 56.95 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.762 -179.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -99.05 -98.88 0.22 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.251 -175.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.42 75.84 10.2 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.326 -176.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 5.4 tt . . . . . 0 C--N 1.324 -0.538 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 175.091 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.487 0 N-CA-C 111.634 -0.586 . . . . 0.0 111.634 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . 0.538 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -120.66 138.66 53.82 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.947 0.403 . . . . 0.0 111.431 -178.849 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 35.5 mm -101.06 142.16 16.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.836 178.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . 0.455 ' HB3' ' HA ' ' A' ' 124' ' ' PRO . . . -52.9 136.52 46.48 Favored Pre-proline 0 C--O 1.233 0.218 0 CA-C-O 120.757 0.313 . . . . 0.0 111.209 177.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . 0.5 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 11.7 Cg_exo -72.17 2.17 5.24 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.521 2.814 . . . . 0.0 113.335 -174.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . 0.5 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 10.0 m-85 73.89 156.95 0.16 Allowed Pre-proline 0 N--CA 1.469 0.505 0 O-C-N 123.673 0.608 . . . . 0.0 111.395 178.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -83.71 136.02 7.1 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.882 2.388 . . . . 0.0 112.05 177.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . 0.449 ' OE2' ' HD3' ' A' ' 102' ' ' ARG . 1.0 OUTLIER -137.87 177.82 7.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.162 179.358 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -97.31 126.55 42.6 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.786 0.327 . . . . 0.0 110.626 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -94.84 -168.25 1.78 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.377 178.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.443 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.4 OUTLIER -71.86 128.62 89.22 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.394 179.708 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . 0.797 ' HG3' ' HB2' ' A' ' 96' ' ' ALA . 10.0 Cg_exo -72.2 130.42 16.4 Favored 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 122.959 2.439 . . . . 0.0 112.626 -175.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.475 ' HA ' ' HB2' ' A' ' 84' ' ' SER . 0.4 OUTLIER -79.29 161.18 26.45 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.1 178.122 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.535 0.386 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 . . . . . 0 C--O 1.228 -0.051 0 CA-C-O 121.003 0.43 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.677 ' HB2' ' HA ' ' A' ' 83' ' ' ASN . 0.8 OUTLIER -140.46 131.14 25.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.757 -177.867 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -81.1 104.41 11.57 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 176.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.43 5.43 86.99 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.468 -0.873 . . . . 0.0 111.892 -177.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.677 ' HA ' ' HB2' ' A' ' 80' ' ' LEU . 23.5 t-20 59.7 55.6 3.92 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.133 0.492 . . . . 0.0 111.434 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.41 ' HB2' ' N ' ' A' ' 415' ' ' SER . 29.1 m -157.96 107.4 2.09 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.415 175.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.36 133.29 1.79 Allowed Glycine 0 CA--C 1.519 0.328 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.824 178.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.43 ' HA ' ' HA ' ' A' ' 93' ' ' SER . . . -167.4 150.71 6.28 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 177.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.93 145.96 30.61 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.15 -10.76 59.06 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.08 -170.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.812 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -85.14 -46.91 10.66 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.164 -176.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.553 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 30.5 p -102.95 -77.35 0.56 Allowed 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.873 -178.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.553 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 147.33 -1.12 0.72 Allowed Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.742 -177.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -83.21 146.02 28.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.895 0.379 . . . . 0.0 110.181 177.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.43 ' HA ' ' HA ' ' A' ' 86' ' ' ALA . 1.2 m -76.48 169.09 18.91 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.159 176.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.7 mt -111.25 104.74 56.52 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-O 120.744 0.307 . . . . 0.0 111.244 -176.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.912 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 2.9 Cg_exo -76.29 167.75 25.22 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.853 2.369 . . . . 0.0 111.012 173.039 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.24 -9.01 51.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.06 0.457 . . . . 0.0 111.195 -178.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.31 -10.77 34.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.876 178.332 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.912 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 3.3 mm-40 -101.81 163.13 12.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.506 -179.333 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.559 ' HB2' HD12 ' A' ' 110' ' ' LEU . 10.3 mt -132.66 133.75 43.97 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.524 -178.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.406 HG12 ' HA ' ' A' ' 109' ' ' HIS . 2.0 m -118.21 148.97 20.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.828 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.64 121.97 37.91 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 175.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.406 ' HA ' HG12 ' A' ' 107' ' ' VAL . 14.4 ttt85 -88.52 129.21 35.52 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.47 -175.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -112.22 -147.93 0.42 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.59 77.79 2.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.934 0.397 . . . . 0.0 110.736 178.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.5 -42.39 2.7 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.857 -0.611 . . . . 0.0 112.603 176.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -89.7 156.24 18.68 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.838 0.351 . . . . 0.0 110.797 -178.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.406 HG12 ' HA ' ' A' ' 102' ' ' ARG . 0.4 OUTLIER -127.95 148.87 32.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.592 179.688 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -136.63 149.92 48.25 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 178.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.896 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 33.9 m80 -71.35 171.35 11.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.902 0.382 . . . . 0.0 110.798 -177.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.559 HD12 ' HB2' ' A' ' 99' ' ' LEU . 0.3 OUTLIER -61.26 -26.19 67.59 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.101 0.477 . . . . 0.0 111.171 175.971 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.417 ' HG2' ' H ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.82 -20.64 22.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.881 177.478 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.896 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 7.5 m -100.31 -18.65 16.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.184 -170.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -67.6 83.57 0.18 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.086 0.47 . . . . 0.0 110.201 176.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.574 HG22 ' HA ' ' A' ' 121' ' ' ARG . 2.5 p -135.67 160.63 37.91 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.528 -174.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.532 ' HB3' ' H ' ' A' ' 120' ' ' ASN . 37.2 t -60.88 154.18 22.86 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.626 177.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 1.2 m -95.64 -10.39 29.53 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.092 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -107.94 -52.48 2.76 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.839 -0.345 . . . . 0.0 111.815 -179.444 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.414 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -98.97 -20.09 16.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.11 0.481 . . . . 0.0 109.96 179.124 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.517 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.1 OUTLIER 64.94 37.54 6.91 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.891 -178.288 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . 0.55 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 72.8 m-20 -75.53 140.95 43.05 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 174.394 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.574 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.1 OUTLIER -77.6 112.41 14.37 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 176.492 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.547 HD13 ' HB2' ' A' ' 128' ' ' PHE . 10.0 mt -70.7 152.46 43.81 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.362 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 8.9 t -119.09 135.04 23.65 Favored Pre-proline 0 C--N 1.325 -0.468 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.955 -168.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -56.99 111.59 0.85 Allowed 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 122.581 2.187 . . . . 0.0 111.207 174.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.59 5.9 56.6 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.513 -178.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -126.05 -173.95 2.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.757 0.313 . . . . 0.0 111.043 177.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.457 ' HA ' ' O ' ' A' ' 208' ' ' SER . 6.9 mmt-85 -73.86 136.64 43.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.383 0.611 . . . . 0.0 112.294 -171.131 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.547 ' HB2' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -148.84 153.28 37.86 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.966 -1.015 . . . . 0.0 108.578 175.517 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -135.45 133.62 38.76 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.492 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.406 ' HA ' ' O ' ' A' ' 134' ' ' SER . 5.1 t80 -126.17 102.11 7.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.378 175.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.47 HD12 ' HD2' ' A' ' 136' ' ' PHE . 2.8 mp -127.68 128.04 69.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 -178.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.5 m120 61.02 32.56 19.86 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.579 0.549 . . . . 0.0 111.016 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 68.07 35.27 83.4 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.436 -0.888 . . . . 0.0 112.037 -178.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.406 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.7 OUTLIER -138.41 146.91 42.77 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -178.253 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 9.6 mt -99.34 129.12 45.52 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.899 0.38 . . . . 0.0 110.617 -176.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.47 ' HD2' HD12 ' A' ' 131' ' ' ILE . 69.2 m-85 -129.44 161.24 30.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.501 179.4 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . 0.55 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 6.1 m -93.31 176.1 6.52 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.059 0.456 . . . . 0.0 109.831 175.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.95 -14.22 59.61 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 162.247 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . 0.46 ' HB3' ' HB2' ' A' ' 137' ' ' CYS . 67.8 t60 -70.11 -46.83 63.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.129 -1.396 . . . . 0.0 110.517 177.221 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.414 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 1.9 p-10 -109.83 13.52 23.54 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.281 -177.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . 0.447 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 22.2 ttt-85 -47.55 114.4 3.1 Favored Pre-proline 0 N--CA 1.468 0.445 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.998 -177.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 6.0 Cg_exo -79.85 118.92 3.86 Favored 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 123.286 2.657 . . . . 0.0 112.262 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -11.21 60.66 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -99.24 -18.61 17.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.949 0.404 . . . . 0.0 111.355 -179.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 1.2 mt -127.79 83.4 2.16 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.009 0.433 . . . . 0.0 110.31 -178.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.035 -179.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.459 0 N-CA-C 112.588 -0.205 . . . . 0.0 112.588 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . 0.457 ' O ' ' HA ' ' A' ' 127' ' ' ARG . 0.0 OUTLIER -73.09 148.58 43.86 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.862 0.363 . . . . 0.0 110.599 178.731 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 48.3 mm -104.42 136.89 35.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.348 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -60.82 126.11 84.67 Favored Pre-proline 0 C--N 1.33 -0.261 0 O-C-N 123.42 0.45 . . . . 0.0 109.955 176.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . 0.552 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 82.9 Cg_exo -44.05 -71.06 0.06 OUTLIER 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.722 2.948 . . . . 0.0 113.133 -173.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . 0.552 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 0.2 OUTLIER 149.92 157.93 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.691 0 C-N-CA 125.185 1.394 . . . . 0.0 108.739 177.558 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . 0.532 ' HD2' ' CD2' ' A' ' 407' ' ' PHE . 39.7 Cg_exo -61.42 132.29 40.23 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.692 2.261 . . . . 0.0 112.05 174.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -138.4 154.38 48.91 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.956 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -86.73 130.84 34.32 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 176.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -107.38 -120.3 0.25 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.258 -177.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.426 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.2 OUTLIER -96.38 129.13 34.23 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.156 -179.217 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 20.7 Cg_exo -66.17 151.23 84.13 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 123.213 2.609 . . . . 0.0 112.771 -177.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 26.5 m -68.32 141.96 55.65 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.815 177.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . 0.41 ' N ' ' HB2' ' A' ' 84' ' ' SER . 12.6 p . . . . . 0 N--CA 1.467 0.376 0 O-C-N 124.094 0.871 . . . . 0.0 111.704 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.7 ttp180 . . . . . 0 N--CA 1.454 -0.238 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.639 ' HB3' ' HA ' ' A' ' 83' ' ' ASN . 2.6 mm? -105.77 117.53 34.26 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 114.582 -1.19 . . . . 0.0 110.681 -173.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -70.36 -48.5 56.04 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.706 178.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -102.87 -12.8 31.19 Favored Glycine 0 N--CA 1.454 -0.155 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.203 178.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.639 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 1.4 t30 67.77 37.36 3.23 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.083 0.468 . . . . 0.0 111.243 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -116.16 -69.84 0.83 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.801 179.233 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . 0.459 ' O ' ' HA ' ' A' ' 93' ' ' SER . . . -133.64 143.42 15.1 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.983 -0.627 . . . . 0.0 111.999 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -147.88 170.77 16.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.708 0.254 . . . . 0.0 110.679 -177.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.665 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 50.4 t -75.01 145.77 42.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.567 179.144 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.7 m -80.93 -9.6 59.81 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.372 176.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -113.75 -58.01 2.21 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.802 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 37.7 m -71.19 -43.04 68.2 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.481 0.658 . . . . 0.0 109.972 178.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.665 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 87.2 0.28 85.21 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.586 -176.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.03 132.37 38.91 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.459 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 0.0 OUTLIER -57.89 123.38 15.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 175.917 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.453 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 8.0 mt -79.24 117.13 65.27 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.26 -176.294 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.538 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 2.7 Cg_exo -77.66 158.89 31.97 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 123.098 2.532 . . . . 0.0 111.271 174.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.713 ' HB2' ' HB3' ' A' ' 413' ' ' PRO . . . -66.37 -21.76 66.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.226 0.536 . . . . 0.0 111.001 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.96 2.39 30.95 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.509 -179.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.538 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -107.88 159.32 16.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.075 0.464 . . . . 0.0 110.904 -178.732 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.2 mt -121.42 124.66 45.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.574 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.551 ' HB ' ' O ' ' A' ' 108' ' ' TYR . 19.2 m -123.44 169.51 14.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.135 -173.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -115.77 112.26 21.75 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.22 0.533 . . . . 0.0 109.943 178.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.71 98.06 10.18 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.261 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -74.64 -45.37 45.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.504 178.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.434 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -161.53 -129.18 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -179.988 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.434 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -66.24 -22.37 70.88 Favored Glycine 0 N--CA 1.451 -0.326 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 173.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -89.15 135.37 33.6 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 2.5 p -123.12 128.24 74.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.442 -177.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . 0.551 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 38.7 m-85 -125.49 176.61 6.71 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.147 -179.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.79 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 70.4 m80 -99.42 -149.58 0.36 Allowed 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 175.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.425 ' H ' ' HG ' ' A' ' 110' ' ' LEU . 0.0 OUTLIER -86.87 -30.12 21.66 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.146 174.4 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.432 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.8 -34.02 16.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.797 0.332 . . . . 0.0 111.863 -172.239 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.79 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.1 OUTLIER -75.74 -19.4 59.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.261 0.553 . . . . 0.0 110.498 -176.402 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -76.41 72.31 3.13 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.412 176.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.635 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.1 p -137.79 157.95 45.37 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.453 -178.286 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.452 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 11.4 p -79.02 154.25 29.62 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 120.867 0.365 . . . . 0.0 110.247 176.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -53.78 18.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -174.128 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.6 -50.8 14.43 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -168.164 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.31 -13.58 19.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.595 0.236 . . . . 0.0 111.422 -175.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.452 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.9 OUTLIER 63.33 42.98 6.44 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.658 -179.389 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -77.99 122.7 25.88 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.408 176.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.635 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.0 OUTLIER -73.25 122.68 22.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.733 0.301 . . . . 0.0 110.683 179.802 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.491 HD22 ' HB2' ' A' ' 128' ' ' PHE . 8.9 mt -71.83 143.08 49.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 176.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.3 t -139.17 138.36 20.73 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-O 121.031 0.443 . . . . 0.0 111.568 -166.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.3 110.98 1.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.576 2.184 . . . . 0.0 110.865 175.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 120.77 -15.86 9.61 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 -175.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -113.72 -159.44 0.69 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 127' ' ' ARG . 0.0 OUTLIER -118.99 129.36 55.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.158 0.504 . . . . 0.0 111.444 -175.754 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.491 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.6 OUTLIER -117.53 138.64 51.76 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 172.538 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -104.88 108.98 20.76 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.93 0.395 . . . . 0.0 111.068 -177.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -95.77 100.86 12.52 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 174.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 57.1 mt -122.95 122.88 66.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.089 -175.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.4 t30 58.85 28.77 17.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.599 -176.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 73.38 32.66 59.68 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.34 -178.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 3.9 m -132.57 155.92 47.8 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 -177.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 67.3 mt -95.72 116.62 29.14 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 123.242 0.339 . . . . 0.0 110.821 -176.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -125.79 150.83 47.47 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.916 177.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . 0.563 ' SG ' ' HB2' ' A' ' 139' ' ' HIS . 17.8 p -99.47 -172.39 2.25 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.357 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -77.56 -20.83 53.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.873 0.368 . . . . 0.0 110.744 177.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . 0.563 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 1.0 OUTLIER -81.81 -38.82 24.95 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 178.252 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.484 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 2.0 m-20 -74.74 -31.24 61.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.586 178.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -20.79 101.88 0.07 OUTLIER Pre-proline 0 N--CA 1.47 0.538 0 O-C-N 125.294 1.621 . . . . 0.0 114.103 -177.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -70.74 162.61 41.98 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 122.901 2.401 . . . . 0.0 112.322 176.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 98.4 m -110.12 150.4 28.65 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.89 176.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . 73.94 -62.04 0.48 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.399 0.679 . . . . 0.0 111.607 178.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.62 62.29 7.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.094 0.473 . . . . 0.0 110.206 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.516 ' H ' HG13 ' A' ' 146' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.578 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.311 178.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.645 0 N-CA-C 111.868 -0.493 . . . . 0.0 111.868 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.09 162.74 34.21 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 -177.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . 0.426 ' O ' ' HD1' ' A' ' 128' ' ' PHE . 15.4 mm -125.05 -94.03 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 O-C-N 123.292 0.37 . . . . 0.0 110.067 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . 0.439 ' HA ' ' CD1' ' A' ' 128' ' ' PHE . . . -169.9 157.34 6.25 Favored Pre-proline 0 C--O 1.234 0.244 0 N-CA-C 110.41 -0.219 . . . . 0.0 110.41 -177.224 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . 0.496 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 73.6 Cg_endo -77.76 -19.3 12.78 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.293 1.995 . . . . 0.0 111.318 174.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . 0.496 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 4.4 m-85 76.17 149.93 0.13 Allowed Pre-proline 0 CA--C 1.533 0.312 0 O-C-N 124.419 1.074 . . . . 0.0 111.381 177.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.38 116.54 4.35 Favored 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.564 2.176 . . . . 0.0 112.646 178.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -136.8 177.31 7.96 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.927 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -89.58 134.33 34.18 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.144 -179.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -107.21 -166.38 1.15 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.429 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 2.4 mp -67.64 122.49 83.65 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.321 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . 0.713 ' HB3' ' HB2' ' A' ' 96' ' ' ALA . 7.0 Cg_exo -72.92 135.85 24.05 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 123.088 2.525 . . . . 0.0 113.04 -175.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -67.08 153.39 43.78 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.601 176.06 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.463 0.187 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.673 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.163 0 CA-C-O 121.337 0.589 . . . . 0.0 110.085 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.631 ' HG ' ' HB2' ' A' ' 86' ' ' ALA . 5.1 mp -99.53 14.42 29.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.72 -173.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.561 ' HB2' ' OG ' ' A' ' 93' ' ' SER . 0.2 OUTLIER 47.58 56.25 7.31 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 123.624 0.578 . . . . 0.0 112.184 176.322 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.33 5.2 59.34 Favored Glycine 0 C--N 1.327 0.046 0 C-N-CA 120.429 -0.891 . . . . 0.0 111.981 -178.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.467 ' HA ' ' CB ' ' A' ' 80' ' ' LEU . 61.3 t30 69.24 65.49 0.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 123.68 0.792 . . . . 0.0 112.285 175.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.526 ' CB ' ' HA ' ' A' ' 414' ' ' THR . 0.1 OUTLIER -106.36 -55.28 2.35 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.981 173.382 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -162.95 167.36 37.3 Favored Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.631 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . . . -153.31 135.16 14.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.71 0.29 . . . . 0.0 110.661 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.445 ' HB2' ' CE1' ' A' ' 109' ' ' HIS . 19.0 t -67.4 145.43 55.04 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.336 175.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.7 m -79.11 -0.14 30.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.356 178.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.531 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -124.95 -55.78 1.58 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.68 -0.236 . . . . 0.0 111.188 176.528 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 25.4 m -76.37 -26.67 55.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.786 0.327 . . . . 0.0 111.137 -178.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.25 32.68 84.59 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.287 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.44 ' NE2' ' H ' ' A' ' 93' ' ' SER . 0.0 OUTLIER -119.63 162.5 18.87 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.631 0.253 . . . . 0.0 110.406 179.831 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.561 ' OG ' ' HB2' ' A' ' 81' ' ' PHE . 0.7 OUTLIER -78.64 171.09 15.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.998 -178.684 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.705 HG12 HG11 ' A' ' 100' ' ' VAL . 2.3 mp -127.44 119.68 21.84 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.058 -175.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.666 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 7.8 Cg_exo -74.11 167.53 26.96 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.817 2.345 . . . . 0.0 111.12 171.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.4 -12.4 61.39 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.086 0.469 . . . . 0.0 111.183 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.98 -14.03 34.88 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.168 -179.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.666 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -94.92 102.7 14.55 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.032 0.444 . . . . 0.0 110.966 -174.445 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.418 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 62.5 mt -71.66 126.59 30.1 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 173.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.705 HG11 HG12 ' A' ' 94' ' ' ILE . 13.8 m -122.25 149.11 25.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.094 -174.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.28 153.75 21.76 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.66 155.46 49.67 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.701 -178.054 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -124.38 -113.4 0.3 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.019 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -92.68 75.46 5.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.111 0.481 . . . . 0.0 110.688 -178.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.82 -39.12 3.09 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.748 178.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -89.74 167.22 13.05 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.671 0.272 . . . . 0.0 110.92 -178.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 2.5 m -124.0 160.99 27.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 121.356 0.598 . . . . 0.0 112.588 -173.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . 0.651 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 73.7 m-85 -139.32 -170.26 2.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.654 -1.157 . . . . 0.0 107.977 173.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.831 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 71.7 m80 -112.29 -155.06 0.56 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 173.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -84.36 -25.31 29.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.139 0.495 . . . . 0.0 110.875 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.21 -32.84 16.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.084 -175.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.831 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -84.63 -16.34 42.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.655 -172.241 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -78.25 65.09 3.52 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.457 0.646 . . . . 0.0 110.624 179.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.673 HG22 ' HA ' ' A' ' 121' ' ' ARG . 12.1 p -121.35 164.52 16.93 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.892 -178.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.746 ' HB3' ' H ' ' A' ' 120' ' ' ASN . 41.3 t -60.24 152.74 24.02 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.203 172.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.97 -14.77 20.42 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.719 178.675 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.98 -50.94 4.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.594 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.56 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -106.63 -11.26 15.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.189 -178.35 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.621 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 61.61 36.2 16.85 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.592 -178.041 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . 0.746 ' H ' ' HB3' ' A' ' 115' ' ' CYS . 1.2 t30 -80.44 130.46 35.17 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 176.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.673 ' HA ' HG22 ' A' ' 114' ' ' THR . 1.6 ttp85 -76.29 117.83 18.37 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.887 0.375 . . . . 0.0 110.602 -177.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.4 mt -66.39 150.81 48.34 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.757 -177.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 11.7 t -131.77 140.95 39.86 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.066 -171.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -56.21 111.03 0.66 Allowed 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.375 2.05 . . . . 0.0 111.074 172.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.33 -19.58 13.04 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 -174.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -100.76 167.5 10.27 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 2.2 mtm-85 -106.52 145.89 31.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.02 0.438 . . . . 0.0 111.776 -173.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -129.11 149.24 51.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.861 174.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . 0.547 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 87.8 m-70 -117.06 109.26 16.75 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.535 -177.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.48 ' HA ' ' O ' ' A' ' 134' ' ' SER . 1.6 t80 -92.7 102.22 14.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.066 0.46 . . . . 0.0 109.846 178.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 12.0 mt -123.13 122.66 66.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.874 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 62.3 26.47 15.83 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.665 0.603 . . . . 0.0 111.086 178.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 78.28 34.19 37.51 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.229 -179.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.48 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.4 OUTLIER -139.0 152.73 47.88 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -177.859 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.3 mt -102.39 114.08 27.96 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.481 -174.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.547 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 64.9 m-85 -109.44 150.51 27.99 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 174.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . 0.473 ' HB3' ' HB2' ' A' ' 115' ' ' CYS . 11.4 p -114.47 176.13 5.18 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.393 -176.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -68.22 -17.53 64.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.308 -175.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . 0.405 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 26.7 t60 -75.18 -45.94 37.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.114 -176.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.56 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 10.2 p-10 -93.17 -39.48 11.0 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.069 -177.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 24.24 84.86 0.12 Allowed Pre-proline 0 N--CA 1.477 0.911 0 O-C-N 124.507 1.13 . . . . 0.0 113.761 176.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.38 134.29 63.38 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.767 2.311 . . . . 0.0 112.879 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.6 m -104.7 -25.71 12.58 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.102 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -68.63 -50.78 48.69 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.899 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.08 102.09 5.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.63 178.184 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 2.3 tt . . . . . 0 C--N 1.323 -0.544 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.982 178.43 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.54 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.22 140.92 38.91 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.036 0.446 . . . . 0.0 111.274 -175.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 26.7 mm -71.55 146.89 11.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 172.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . 0.433 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -48.28 117.53 5.85 Favored Pre-proline 0 C--N 1.33 -0.26 0 O-C-N 123.313 0.383 . . . . 0.0 110.509 176.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . 0.459 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 14.6 Cg_exo -69.85 8.13 0.86 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.748 2.965 . . . . 0.0 113.732 -172.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . 0.459 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 33.2 m-85 71.07 159.71 0.16 Allowed Pre-proline 0 C--O 1.234 0.252 0 O-C-N 123.76 0.663 . . . . 0.0 111.248 178.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . 0.418 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 2.9 Cg_exo -76.28 132.05 13.4 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.791 2.327 . . . . 0.0 111.787 175.27 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.32 177.25 7.83 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.823 178.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -85.89 142.27 28.98 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.271 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . 0.485 ' HB2' HG21 ' A' ' 100' ' ' VAL . . . -103.4 -134.15 0.32 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.778 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.467 HD13 ' HA ' ' A' ' 412' ' ' LEU . 1.1 mm? -100.17 124.99 41.29 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 178.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 34.2 Cg_exo -58.79 150.67 69.59 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 123.077 2.518 . . . . 0.0 112.705 179.223 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.526 ' HA ' ' CB ' ' A' ' 84' ' ' SER . 0.3 OUTLIER -67.67 149.78 49.57 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.297 -178.261 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 CA--C 1.531 0.233 0 CA-C-O 121.362 0.601 . . . . 0.0 112.134 179.733 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.715 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--O 1.227 -0.13 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.71 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.4 OUTLIER -126.79 169.13 13.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.71 0.29 . . . . 0.0 110.982 -176.538 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 -88.34 114.23 24.75 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.214 -178.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.482 ' HA3' ' CB ' ' A' ' 415' ' ' SER . . . 102.54 -33.92 6.15 Favored Glycine 0 C--N 1.33 0.247 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 -177.113 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . 0.426 ' HA ' ' CD2' ' A' ' 80' ' ' LEU . 2.3 t30 67.22 83.82 0.16 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 172.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.656 ' H ' HD11 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -139.68 -43.06 0.44 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.153 173.446 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . 0.471 ' O ' HG21 ' A' ' 414' ' ' THR . . . -167.76 140.33 6.18 Favored Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 111.114 -0.794 . . . . 0.0 111.114 178.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.71 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -141.18 164.91 28.98 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 117.005 0.403 . . . . 0.0 111.488 -174.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.704 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 37.7 t -65.41 144.49 57.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.357 176.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.82 -15.97 61.62 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.007 178.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.439 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -111.21 -59.35 1.98 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.636 -0.257 . . . . 0.0 111.257 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 10.5 m -74.32 -43.61 56.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.35 0.595 . . . . 0.0 110.729 -179.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.715 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 81.62 12.58 81.49 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.962 -176.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -75.99 148.29 38.19 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.867 0.365 . . . . 0.0 110.854 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.508 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -69.55 129.27 39.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.9 176.147 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.5 mt -94.05 108.75 37.65 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-O 120.963 0.411 . . . . 0.0 111.048 -178.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.687 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 9.5 Cg_exo -72.76 167.19 27.87 Favored 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.772 2.314 . . . . 0.0 111.673 175.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.627 ' HB2' ' HB3' ' A' ' 413' ' ' PRO . . . -74.96 -3.76 34.18 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.995 0.426 . . . . 0.0 111.383 -179.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.31 -4.03 30.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.654 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.687 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.3 OUTLIER -94.11 123.4 37.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.304 -174.462 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.6 mt -89.45 114.7 26.22 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 173.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -115.82 141.9 31.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.275 -171.194 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.507 ' HA ' ' HA ' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -82.61 111.39 18.54 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.632 -177.623 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.461 ' H ' ' HG3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -111.52 127.4 55.7 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.104 -176.538 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.4 ' HA ' ' HG3' ' A' ' 406' ' ' PRO . . . -72.56 -39.15 67.68 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.067 0.461 . . . . 0.0 110.083 176.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.516 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 1.8 tp-100 -171.73 -100.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.656 -179.111 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . 0.516 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -83.97 -17.98 64.16 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.934 -0.65 . . . . 0.0 111.724 177.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -101.99 149.4 24.27 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 9.7 p -122.7 148.45 26.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.221 -173.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -139.69 -170.25 2.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.656 177.08 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.761 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 69.1 m80 -114.17 -161.59 0.77 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 173.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.3 mp -85.35 -19.43 31.46 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.235 0.541 . . . . 0.0 111.037 179.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.498 ' HA ' ' NH1' ' A' ' 121' ' ' ARG . 0.0 OUTLIER -90.16 -38.41 13.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.436 -176.105 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.761 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.56 -28.29 56.21 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.366 -174.182 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.45 82.23 0.79 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.038 -179.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.9 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.1 p -143.97 161.05 39.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.199 -176.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.565 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 1.7 t -67.62 142.23 56.5 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 173.59 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.98 -11.88 51.87 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.869 0.366 . . . . 0.0 111.091 -177.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.489 ' HB ' ' OD2' ' A' ' 140' ' ' ASP . 0.2 OUTLIER -91.62 -51.01 5.46 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -174.813 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.618 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 22.2 p -115.83 -7.42 12.05 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.886 0.374 . . . . 0.0 110.73 -178.245 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.565 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 70.99 27.4 3.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.981 -177.065 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . 0.618 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 3.7 t-20 -54.2 119.24 4.85 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.241 172.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.9 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.0 OUTLIER -69.39 108.24 3.65 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 177.277 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.713 HD22 ' HB2' ' A' ' 128' ' ' PHE . 40.4 mt -63.46 137.58 58.2 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -179.082 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 53.9 t -122.59 132.0 24.32 Favored Pre-proline 0 C--N 1.323 -0.573 0 C-N-CA 121.004 -0.279 . . . . 0.0 110.601 -172.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.44 110.88 0.78 Allowed 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.285 1.99 . . . . 0.0 110.638 173.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 110.45 -13.05 30.61 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.604 -175.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -108.0 172.43 6.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.762 0.315 . . . . 0.0 110.293 178.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.723 ' HB3' ' HB3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -79.15 138.24 37.81 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.056 -174.268 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.713 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -146.8 160.08 42.71 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.051 176.108 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . 0.506 ' HB3' HD11 ' A' ' 131' ' ' ILE . 8.3 m-70 -127.31 134.72 49.98 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.035 0.445 . . . . 0.0 111.035 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.563 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 12.9 t80 -124.22 103.21 8.11 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -179.783 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.514 HD12 HD12 ' A' ' 146' ' ' ILE . 0.0 OUTLIER -121.75 117.54 52.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.345 -179.635 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 52.7 t30 57.1 35.87 26.87 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.77 0.669 . . . . 0.0 110.842 177.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.563 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 75.21 35.53 48.42 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.617 -0.802 . . . . 0.0 113.109 179.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -130.75 139.17 50.23 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 117.126 0.463 . . . . 0.0 110.136 179.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.421 ' HB3' HD11 ' A' ' 122' ' ' LEU . 10.7 mt -94.55 116.14 28.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.081 0.467 . . . . 0.0 110.924 -177.19 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -125.69 159.76 31.43 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.307 177.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . 0.478 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 21.2 p -91.6 173.08 8.07 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 177.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.723 ' HB3' ' HB3' ' A' ' 127' ' ' ARG . 0.3 OUTLIER -74.76 -14.68 60.74 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 175.535 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . 0.478 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 15.4 t60 -84.46 -24.19 29.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.517 -177.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.489 ' OD2' ' HB ' ' A' ' 117' ' ' THR . 40.3 m-20 -120.77 17.88 11.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.349 -176.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' A' ' 141' ' ' ARG . 4.5 ptm180 -53.67 120.81 24.42 Favored Pre-proline 0 C--O 1.235 0.305 0 CA-C-O 121.341 0.591 . . . . 0.0 111.307 -176.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 24.3 Cg_exo -64.13 128.99 23.01 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.908 2.405 . . . . 0.0 112.034 -179.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -98.06 -33.93 10.98 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.318 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -96.61 14.63 24.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.452 0.644 . . . . 0.0 110.471 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -146.0 55.93 1.18 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.603 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . 0.514 HD12 HD12 ' A' ' 131' ' ' ILE . 7.0 tt . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.39 -176.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.647 0 N-CA-C 112.343 -0.303 . . . . 0.0 112.343 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . 0.408 ' O ' ' HA ' ' A' ' 127' ' ' ARG . 0.4 OUTLIER -90.14 174.88 7.38 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 177.997 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 49.7 mm -104.62 136.16 39.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -61.37 124.2 79.66 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.764 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . 0.4 ' HG3' ' HA ' ' A' ' 103' ' ' ALA . 11.5 Cg_endo -57.14 150.85 54.49 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.885 2.39 . . . . 0.0 112.373 178.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -86.03 155.32 58.08 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.321 -174.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . 0.507 ' HA ' ' HA ' ' A' ' 101' ' ' MET . 64.6 Cg_endo -76.49 117.41 4.56 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.586 2.191 . . . . 0.0 112.054 175.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -127.44 166.86 17.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.792 -178.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -74.77 109.92 8.64 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 176.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -89.83 -83.78 0.24 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.229 -174.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 412' ' ' LEU . 1.3 pt? -131.47 129.81 22.31 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.784 -176.034 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . 0.627 ' HB3' ' HB2' ' A' ' 96' ' ' ALA . 73.8 Cg_endo -80.68 121.18 4.08 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.509 2.139 . . . . 0.0 111.164 172.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.471 HG21 ' O ' ' A' ' 85' ' ' GLY . 32.4 p -93.47 -126.67 0.1 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -176.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . 0.482 ' CB ' ' HA3' ' A' ' 82' ' ' GLY . 0.3 OUTLIER . . . . . 0 C--N 1.324 -0.522 0 CA-C-O 121.017 0.437 . . . . 0.0 111.767 -176.428 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.607 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER . . . . . 0 CA--C 1.522 -0.123 0 CA-C-O 121.061 0.458 . . . . 0.0 110.189 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.79 109.3 9.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.707 179.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -78.16 93.89 4.64 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.483 0.659 . . . . 0.0 110.462 -177.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.527 ' HA3' ' HA ' ' A' ' 415' ' ' SER . . . 123.45 -20.11 7.47 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.073 -175.236 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 64.14 18.94 11.55 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.548 0.739 . . . . 0.0 112.302 176.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.406 ' OG ' ' HA ' ' A' ' 414' ' ' THR . 0.2 OUTLIER -91.74 -14.09 30.52 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.848 176.947 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 151.43 170.14 17.92 Favored Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.001 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -167.93 163.81 13.83 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 178.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.607 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 43.3 t -68.5 145.78 53.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.058 0.456 . . . . 0.0 110.111 175.284 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -94.74 -1.71 52.44 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.793 179.11 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.45 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -112.41 -51.68 2.83 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.866 0.365 . . . . 0.0 110.338 177.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 34.8 m -77.78 -52.89 8.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.843 175.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.607 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 96.82 1.76 59.9 Favored Glycine 0 N--CA 1.443 -0.845 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.768 -176.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.6 134.88 34.38 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 177.433 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . 0.738 ' HB3' HG21 ' A' ' 414' ' ' THR . 1.0 OUTLIER -65.69 148.3 51.98 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.16 176.735 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.8 mt -103.37 116.18 62.56 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -168.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -77.53 167.28 24.55 Favored 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.833 2.355 . . . . 0.0 111.028 170.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.08 7.27 6.41 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -176.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.67 -35.67 14.81 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -175.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -96.49 127.32 42.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.881 0.372 . . . . 0.0 110.785 -176.305 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.608 HD23 ' HB2' ' A' ' 408' ' ' PRO . 0.8 OUTLIER -79.69 125.2 29.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.64 176.486 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.834 HG21 ' HB2' ' A' ' 411' ' ' ALA . 29.8 m -115.91 -172.48 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.244 -170.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.8 mmt -122.59 112.7 18.31 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.005 0.431 . . . . 0.0 110.057 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -109.44 119.89 40.83 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.36 -178.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -96.63 -171.8 2.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.1 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.488 HE21 ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -79.58 63.88 4.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.367 0.603 . . . . 0.0 110.085 177.786 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 168.76 -102.32 0.18 Allowed Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.339 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -95.75 178.11 5.56 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.875 0.369 . . . . 0.0 110.729 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 9.6 p -123.76 143.46 36.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.221 0.534 . . . . 0.0 111.659 -174.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . 0.779 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 41.1 m-85 -127.76 -172.84 2.77 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 174.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' HIS . . . . . 0.878 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 73.1 m80 -97.76 -164.53 1.15 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 172.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.6 pp -82.15 -23.57 35.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.895 0.379 . . . . 0.0 111.437 -178.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.427 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.56 -31.03 16.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.075 -175.343 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.878 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -78.79 -5.93 54.63 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.82 -176.342 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.33 76.6 1.86 Allowed 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.413 0.625 . . . . 0.0 110.5 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' THR . . . . . 0.665 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.7 OUTLIER -140.7 155.78 46.39 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.801 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' CYS . . . . . 0.533 ' HB2' ' N ' ' A' ' 119' ' ' ARG . 73.0 m -55.78 146.8 20.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.173 0.511 . . . . 0.0 111.369 175.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.73 -20.45 31.09 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.099 -179.586 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.3 -52.59 2.74 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.633 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 0.1 OUTLIER -94.56 -19.86 20.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.971 0.415 . . . . 0.0 111.08 -174.287 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.533 ' N ' ' HB2' ' A' ' 115' ' ' CYS . 4.9 mmt180 68.82 22.39 7.28 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.936 175.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ASN . . . . . 0.633 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 1.0 OUTLIER -63.9 130.23 43.26 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 171.725 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.665 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.6 OUTLIER -78.84 107.53 11.63 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.057 177.252 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.766 HD22 ' HA ' ' A' ' 128' ' ' PHE . 10.4 mt -63.99 139.73 58.8 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.441 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.477 ' O ' ' HB3' ' A' ' 405' ' ' ALA . 3.0 t -121.86 132.36 24.25 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.436 -170.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 123' ' ' VAL . 40.0 Cg_exo -55.42 110.72 0.59 Allowed 'Trans proline' 0 N--CA 1.461 -0.431 0 C-N-CA 122.59 2.193 . . . . 0.0 111.288 179.132 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 110.81 -16.29 28.4 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.583 -177.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.485 ' O ' ' HA ' ' A' ' 404' ' ' ILE . 3.3 t70 -116.61 -153.36 0.53 Allowed 'General case' 0 C--N 1.326 -0.423 0 O-C-N 122.665 -0.315 . . . . 0.0 110.641 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.64 139.54 43.65 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -171.221 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.766 ' HA ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -157.74 144.94 18.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.929 -1.032 . . . . 0.0 108.618 170.955 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' HIS . . . . . 0.496 ' CD2' ' HD2' ' A' ' 141' ' ' ARG . 8.3 m-70 -137.35 120.57 16.81 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.425 178.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.427 ' HB2' ' CE2' ' A' ' 128' ' ' PHE . 11.0 t80 -115.68 101.14 8.57 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 175.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -126.71 126.57 68.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.553 -178.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.2 t30 58.5 25.72 13.4 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.166 -178.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 78.57 36.38 29.92 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.388 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' SER . . . . . 0.571 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 0.5 OUTLIER -139.55 150.48 45.12 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -179.014 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 43.5 mt -104.22 123.61 47.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.741 0.305 . . . . 0.0 111.489 -174.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.571 ' CE2' ' HB2' ' A' ' 134' ' ' SER . 39.5 m-85 -138.17 178.52 7.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.383 -0.826 . . . . 0.0 108.863 176.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 28.4 p -130.78 -153.18 0.55 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.008 0.432 . . . . 0.0 109.953 174.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.421 ' HA ' ' HD3' ' A' ' 141' ' ' ARG . 1.5 tt0 -77.7 -27.29 50.68 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.458 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -84.17 -53.21 5.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.072 -171.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.553 ' CG ' ' HB3' ' A' ' 118' ' ' CYS . 3.4 p-10 -96.07 31.17 2.21 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.692 0.758 . . . . 0.0 110.741 -178.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . 0.501 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 0.4 OUTLIER -62.29 126.3 87.54 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.855 179.828 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' PRO . . . . . 0.501 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 3.0 Cg_exo -73.93 124.94 9.52 Favored 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.993 2.462 . . . . 0.0 112.205 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.34 53.13 2.69 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.353 0.597 . . . . 0.0 110.905 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -150.43 -77.04 0.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.233 -179.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.69 91.25 7.91 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.769 177.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 12.5 tt . . . . . 0 C--N 1.322 -0.599 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.47 -178.663 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.619 0 CA-C-O 120.701 0.056 . . . . 0.0 113.14 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 208' ' ' SER . . . . . 0.629 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 4.9 m -107.46 129.6 54.93 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 171.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 404' ' ' ILE . . . . . 0.485 ' HA ' ' O ' ' A' ' 126' ' ' ASP . 50.8 mm -109.81 129.85 63.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.787 -172.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 405' ' ' ALA . . . . . 0.529 ' HB2' ' HB3' ' A' ' 128' ' ' PHE . . . -64.69 134.14 95.93 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.969 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 406' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 5.6 Cg_exo -73.88 -176.48 2.62 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 123.011 2.474 . . . . 0.0 112.053 179.333 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -107.09 155.54 39.07 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.867 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 408' ' ' PRO . . . . . 0.608 ' HB2' HD23 ' A' ' 99' ' ' LEU . 53.8 Cg_exo -53.12 134.66 57.06 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.813 2.342 . . . . 0.0 112.846 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.19 175.71 9.33 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.162 -178.155 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -91.23 134.15 34.8 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.051 178.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 411' ' ' ALA . . . . . 0.834 ' HB2' HG21 ' A' ' 100' ' ' VAL . . . -83.51 178.73 7.88 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.417 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.9 tp -72.45 120.57 81.27 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 174.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -55.11 121.41 9.86 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.663 2.242 . . . . 0.0 112.06 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.738 HG21 ' HB3' ' A' ' 93' ' ' SER . 0.2 OUTLIER -82.34 162.17 22.31 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.546 179.821 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 415' ' ' SER . . . . . 0.527 ' HA ' ' HA3' ' A' ' 82' ' ' GLY . 24.2 m . . . . . 0 CA--C 1.529 0.169 0 O-C-N 123.753 0.658 . . . . 0.0 110.058 -174.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.946 0 N-CA-C 112.088 -0.405 . . . . 0.0 112.088 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.66 -26.94 4.43 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.787 0.327 . . . . 0.0 111.342 -176.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -80.83 -14.18 58.28 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.026 0.441 . . . . 0.0 111.372 -174.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.45 104.96 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.39 0.614 . . . . 0.0 111.593 -175.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.782 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 9.3 ptt-85 -124.53 4.29 8.31 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.691 175.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.949 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -94.5 46.73 1.15 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.535 -171.527 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 51.0 35.35 12.52 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 121.498 0.666 . . . . 0.0 110.874 -179.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 121.38 -129.2 7.64 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 110.109 -1.196 . . . . 0.0 110.109 -173.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.589 ' HA ' HD12 ' A' ' 80' ' ' LEU . 64.6 t30 -142.74 79.84 1.67 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.128 0.49 . . . . 0.0 111.462 175.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.29 -55.48 2.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.947 174.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 177.79 144.35 5.42 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.822 179.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.949 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -160.51 158.79 29.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.642 0.221 . . . . 0.0 110.836 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.833 ' HB2' ' HA ' ' A' ' 108' ' ' TYR . 0.1 OUTLIER -86.83 145.76 26.48 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.982 178.474 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.2 -12.54 60.91 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.088 -0.383 . . . . 0.0 111.714 -178.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.527 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -82.86 -47.87 11.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.586 0.231 . . . . 0.0 110.718 -177.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 2.6 p -126.84 -42.87 1.73 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.753 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.782 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 75.19 15.74 80.97 Favored Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.842 -0.617 . . . . 0.0 113.682 179.158 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.3 76.0 8.25 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 117.184 0.492 . . . . 0.0 111.687 -178.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.499 ' HA ' HG21 ' A' ' 414' ' ' THR . 0.7 OUTLIER 62.43 128.67 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 O-C-N 124.228 0.955 . . . . 0.0 113.458 172.765 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.686 HD13 HG11 ' A' ' 100' ' ' VAL . 1.3 mt -103.82 99.51 16.46 Favored Pre-proline 0 C--N 1.32 -0.69 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 170.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.452 ' HD3' ' O ' ' A' ' 93' ' ' SER . 5.4 Cg_exo -78.54 159.17 28.84 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.175 2.583 . . . . 0.0 112.103 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.95 -16.89 56.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.372 0.606 . . . . 0.0 109.674 174.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.1 -35.25 31.9 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.965 -178.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -100.74 118.45 36.86 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.452 ' O ' HD23 ' A' ' 110' ' ' LEU . 1.9 mt -68.78 139.4 55.28 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.66 -179.023 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.686 HG11 HD13 ' A' ' 94' ' ' ILE . 2.7 m -117.74 148.75 20.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.284 0.564 . . . . 0.0 111.38 -176.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.7 115.85 27.38 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.994 -177.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 18.6 ptt180 -112.04 135.46 52.65 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.333 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -113.67 -122.59 0.29 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.201 -177.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.23 -54.13 48.04 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.071 0.462 . . . . 0.0 111.506 -176.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -162.1 31.83 0.32 Allowed Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -140.56 158.77 43.5 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -177.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -120.53 139.76 46.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.691 -176.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . 0.833 ' HA ' ' HB2' ' A' ' 87' ' ' CYS . 74.5 m-85 -137.46 160.34 39.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.36 178.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.787 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 29.0 m80 -85.84 152.2 23.19 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.452 HD23 ' O ' ' A' ' 99' ' ' LEU . 1.5 pp -65.86 -21.17 66.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.0 0.428 . . . . 0.0 111.045 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.428 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.86 -23.47 21.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.196 0.522 . . . . 0.0 110.335 178.572 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.787 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 12.4 m -94.2 -2.3 52.73 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.331 -178.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . 0.602 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.0 OUTLIER -76.62 74.75 3.31 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.229 0.538 . . . . 0.0 110.33 177.127 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.482 HG22 ' HA ' ' A' ' 121' ' ' ARG . 2.2 p -130.6 154.26 48.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.06 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.565 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 17.0 p -72.56 150.91 42.73 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.099 0.476 . . . . 0.0 110.273 177.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -88.05 2.0 52.92 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.478 -177.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -103.62 -50.78 3.34 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -176.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.64 -2.78 10.92 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.841 0.353 . . . . 0.0 110.93 -177.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 62.24 41.15 10.78 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.782 -179.383 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . 0.623 HD22 ' HB2' ' A' ' 137' ' ' CYS . 10.7 t30 -89.44 128.78 35.99 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 177.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.482 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.0 OUTLIER -72.45 126.76 30.63 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.826 0.345 . . . . 0.0 110.316 -177.894 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.794 HD22 ' HB2' ' A' ' 128' ' ' PHE . 0.7 OUTLIER -80.86 132.88 35.5 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.564 179.625 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -127.24 139.28 34.7 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.789 -173.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.98 110.93 0.75 Allowed 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.213 1.942 . . . . 0.0 110.612 171.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 112.65 -5.83 26.16 Favored Glycine 0 N--CA 1.447 -0.586 0 N-CA-C 111.26 -0.736 . . . . 0.0 111.26 -174.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -117.52 165.7 13.24 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 176.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 2.0 mtm-85 -93.81 131.32 39.29 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.122 0.487 . . . . 0.0 111.348 -174.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.794 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -138.63 171.84 13.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.22 -179.386 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 86.1 m-70 -131.94 133.77 44.9 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.786 0.327 . . . . 0.0 110.776 178.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.487 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 69.2 t80 -125.47 101.61 7.01 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 1.5 mt -129.83 128.92 65.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.432 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 63.93 18.28 11.09 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 123.515 0.509 . . . . 0.0 110.992 179.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.487 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 81.82 30.52 35.28 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.225 -176.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.484 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.9 OUTLIER -126.13 155.33 41.84 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 -176.894 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.608 ' HB3' HD11 ' A' ' 122' ' ' LEU . 12.2 mt -108.21 123.7 49.16 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.161 0.505 . . . . 0.0 111.286 -174.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.645 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 22.1 m-85 -129.71 174.9 9.27 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 174.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . 0.623 ' HB2' HD22 ' A' ' 120' ' ' ASN . 10.4 p -127.62 -175.82 3.58 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.457 0.646 . . . . 0.0 111.589 -174.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.475 ' O ' ' HG3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -72.77 -25.52 61.2 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.279 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 47.4 t60 -76.9 -39.2 51.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.769 -175.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.486 ' OD1' ' HB3' ' A' ' 136' ' ' PHE . 1.7 p30 -85.28 -58.77 2.55 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.364 178.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.408 ' N ' ' OD1' ' A' ' 140' ' ' ASP . 0.4 OUTLIER 55.27 72.29 1.09 Allowed Pre-proline 0 C--N 1.327 -0.397 0 C-N-CA 123.146 0.579 . . . . 0.0 111.971 174.019 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.0 99.51 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.39 2.06 . . . . 0.0 111.866 176.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -92.56 -21.25 20.2 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.53 -171.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -68.32 -24.41 64.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.601 -178.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -141.25 60.23 1.51 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.062 0.458 . . . . 0.0 111.253 -178.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -126.82 102.12 8.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.592 0.711 . . . . 0.0 110.102 176.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -72.21 100.0 2.49 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.927 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 123.26 -4.84 9.53 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.599 -0.81 . . . . 0.0 111.944 -177.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -73.47 65.36 1.7 Allowed Glycine 0 C--N 1.332 0.307 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 176.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . 0.404 ' HB2' ' H ' ' A' ' 204' ' ' GLY . 1.2 m -95.5 -101.98 0.16 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.542 -0.329 . . . . 0.0 110.397 179.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . 0.404 ' H ' ' HB2' ' A' ' 203' ' ' SER . . . -86.76 54.91 4.64 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.502 -178.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 82.79 102.57 0.48 Allowed Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.603 -178.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.61 133.37 51.02 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 177.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -112.56 56.94 0.45 Allowed Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.684 -175.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.23 130.33 36.37 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.855 0.359 . . . . 0.0 110.755 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 35.7 mm -120.15 137.47 53.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.912 -176.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . 0.499 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -61.82 133.57 93.77 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.479 -177.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . 0.602 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 15.2 Cg_exo -68.69 172.48 11.51 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.111 2.541 . . . . 0.0 112.401 178.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -97.1 158.1 33.87 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.144 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . 0.416 ' HB2' ' HB2' ' A' ' 99' ' ' LEU . 14.2 Cg_endo -88.91 128.63 1.97 Allowed 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.762 2.308 . . . . 0.0 112.976 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -130.73 163.03 28.16 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -77.29 127.98 33.54 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 122.088 -0.383 . . . . 0.0 110.371 179.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -105.75 -84.29 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.56 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.423 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.4 OUTLIER -131.53 144.27 52.69 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.046 -176.118 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 5.6 Cg_exo -79.38 147.04 19.98 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.886 2.391 . . . . 0.0 111.037 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.499 HG21 ' HA ' ' A' ' 93' ' ' SER . 0.2 OUTLIER -86.55 147.62 25.87 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.831 0.348 . . . . 0.0 111.2 -179.444 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 12.5 m -74.83 136.68 41.57 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.68 177.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -123.78 103.51 34.13 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.629 -0.259 . . . . 0.0 110.576 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -71.02 106.65 1.93 Allowed 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 123.024 2.483 . . . . 0.0 112.38 -179.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.482 -0.771 . . . . 0.0 110.555 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.233 0 N-CA-C 112.159 -0.376 . . . . 0.0 112.159 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.21 89.51 2.53 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.937 0.399 . . . . 0.0 111.515 -177.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -143.22 26.75 1.63 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.204 0.526 . . . . 0.0 110.597 178.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 1.2 mt -83.68 76.84 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.298 0.57 . . . . 0.0 110.722 -176.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.538 ' HE ' ' HA2' ' A' ' 91' ' ' GLY . 19.9 ptt180 -132.72 19.21 4.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.613 176.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.495 HD22 ' HB2' ' A' ' 86' ' ' ALA . 0.9 OUTLIER -113.08 -174.72 2.51 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.89 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -77.73 -35.97 51.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.96 0.409 . . . . 0.0 110.921 -177.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -116.34 -129.53 4.41 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 177.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 18.6 p30 -147.01 22.56 1.22 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.211 0.529 . . . . 0.0 110.356 175.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.87 -58.78 3.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.115 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 93' ' ' SER . . . -170.16 146.78 10.16 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 111.519 -0.633 . . . . 0.0 111.519 179.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.495 ' HB2' HD22 ' A' ' 80' ' ' LEU . . . -129.06 141.83 51.09 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.771 0.319 . . . . 0.0 110.986 -177.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.736 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 41.9 t -62.38 145.84 52.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.137 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.41 -25.42 42.09 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.611 176.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -96.0 -47.95 5.89 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.139 -177.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 56.0 m -83.06 -62.66 1.54 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.254 0.55 . . . . 0.0 110.244 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.736 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 118.19 -19.39 10.92 Favored Glycine 0 N--CA 1.443 -0.875 0 CA-C-N 115.177 -0.92 . . . . 0.0 111.426 -175.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -78.11 177.38 8.38 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.937 0.399 . . . . 0.0 110.922 -178.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 0.5 OUTLIER -84.76 173.82 10.38 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.699 -174.69 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.463 HG12 HG11 ' A' ' 100' ' ' VAL . 2.3 mp -110.38 110.36 58.08 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.862 177.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.4 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 3.1 Cg_exo -78.22 161.49 29.09 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 123.106 2.538 . . . . 0.0 112.127 177.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.19 -16.65 57.68 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.209 0.528 . . . . 0.0 110.987 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -93.8 -21.41 19.31 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.163 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.4 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 1.0 OUTLIER -101.04 108.61 20.35 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.216 0.531 . . . . 0.0 110.064 -179.514 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 14.2 mt -66.96 131.53 46.06 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.249 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.699 ' HB ' ' O ' ' A' ' 108' ' ' TYR . 17.3 m -117.36 166.95 11.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.995 -175.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.9 111.96 20.39 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.436 ' H ' ' HG3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -110.7 139.84 45.61 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.627 -175.914 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -119.78 -165.11 1.13 Allowed 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.134 179.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.01 87.19 7.38 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.909 0.385 . . . . 0.0 110.543 -178.397 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 140.82 -48.03 0.84 Allowed Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.47 176.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -142.59 175.73 9.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.599 0.237 . . . . 0.0 110.383 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 5.0 p -132.6 141.01 46.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.881 -176.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . 0.699 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 1.4 m-85 -120.18 -173.87 2.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.193 175.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.773 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 74.7 m80 -103.91 -157.67 0.62 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 177.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.45 HD12 ' HB3' ' A' ' 408' ' ' PRO . 0.3 OUTLIER -86.53 -22.29 26.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.008 176.248 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.84 -36.02 15.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.611 -174.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.773 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.62 -17.72 59.02 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.531 -174.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -69.87 85.35 0.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.766 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.49 HG23 ' HD2' ' A' ' 121' ' ' ARG . 0.6 OUTLIER -143.09 158.44 43.6 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.653 -178.42 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.47 ' HB3' ' H ' ' A' ' 120' ' ' ASN . 42.2 t -62.1 149.76 40.35 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.878 0.37 . . . . 0.0 110.182 175.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 3.5 m -92.68 -14.09 28.54 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.092 0.472 . . . . 0.0 110.579 178.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.79 -49.6 4.31 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.032 -178.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -116.09 4.58 13.69 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -174.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 63.9 13.2 7.4 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.466 0.707 . . . . 0.0 112.708 175.062 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . 0.558 HD22 ' HB2' ' A' ' 137' ' ' CYS . 13.4 t30 -63.66 123.86 19.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.816 -178.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.49 ' HD2' HG23 ' A' ' 114' ' ' THR . 0.7 OUTLIER -73.31 116.31 13.71 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.982 0.42 . . . . 0.0 110.894 179.282 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.596 HD22 ' HB2' ' A' ' 128' ' ' PHE . 0.7 OUTLIER -75.04 154.51 37.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.126 -179.506 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.496 HG23 ' CB ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -142.54 146.76 40.03 Favored Pre-proline 0 C--N 1.327 -0.402 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.868 -170.015 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -68.06 111.83 2.56 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.823 2.348 . . . . 0.0 111.768 175.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 113.85 -9.36 23.44 Favored Glycine 0 N--CA 1.448 -0.528 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 -177.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.496 ' CB ' HG23 ' A' ' 123' ' ' VAL . 6.4 t70 -105.42 -145.12 0.38 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 173.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.532 ' HD2' ' OE2' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -133.53 146.7 51.29 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.029 0.442 . . . . 0.0 110.992 179.127 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.596 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -143.1 145.4 32.82 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.769 -0.65 . . . . 0.0 109.458 178.148 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -109.39 126.39 53.38 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.108 0.48 . . . . 0.0 110.518 -178.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.449 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 4.6 t80 -124.2 101.5 7.23 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.509 HG21 ' HB3' ' A' ' 145' ' ' LEU . 0.5 OUTLIER -122.46 115.56 46.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.253 -178.709 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 12.1 t30 59.65 42.64 16.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.753 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.449 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 67.52 35.83 87.35 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.792 177.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 14.9 m -133.5 135.89 44.73 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 122.606 -0.35 . . . . 0.0 110.121 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 20.6 mt -89.48 120.94 31.23 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.93 -177.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 -130.11 167.84 17.71 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.442 177.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . 0.558 ' HB2' HD22 ' A' ' 120' ' ' ASN . 4.5 p -132.47 -169.44 2.23 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.076 0.465 . . . . 0.0 111.35 -177.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.532 ' OE2' ' HD2' ' A' ' 127' ' ' ARG . 5.1 mm-40 -72.69 -31.01 64.72 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.572 -173.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 9.2 t-80 -66.24 -43.72 85.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.36 -173.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.466 ' OD2' ' HD3' ' A' ' 142' ' ' PRO . 14.9 p-10 -91.38 -49.85 6.12 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.733 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 41.73 69.56 2.04 Favored Pre-proline 0 N--CA 1.47 0.563 0 O-C-N 123.641 0.588 . . . . 0.0 111.543 178.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.466 ' HD3' ' OD2' ' A' ' 140' ' ' ASP . 32.0 Cg_endo -62.55 92.67 0.14 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.134 2.556 . . . . 0.0 112.756 -174.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.98 6.87 5.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.728 -175.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -87.03 -12.0 48.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.915 172.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.509 ' HB3' HG21 ' A' ' 131' ' ' ILE . 0.5 OUTLIER -110.62 -50.64 2.94 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.321 178.61 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.417 ' H ' HG13 ' A' ' 146' ' ' ILE . 0.0 OUTLIER -81.42 129.67 37.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.274 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.66 93.05 0.49 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -173.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 81.07 -63.59 4.28 Favored Glycine 0 CA--C 1.52 0.369 0 CA-C-N 115.936 -0.575 . . . . 0.0 114.238 168.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 99.19 84.02 1.76 Allowed Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 -172.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -79.94 65.45 5.11 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.921 0.391 . . . . 0.0 111.648 -174.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 78.63 -70.34 2.7 Favored Glycine 0 C--N 1.331 0.263 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -116.62 129.3 8.35 Favored Glycine 0 N--CA 1.443 -0.893 0 N-CA-C 110.576 -1.01 . . . . 0.0 110.576 175.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 25.8 m -146.32 160.19 42.36 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.936 0.368 . . . . 0.0 110.537 -177.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 105.7 -166.21 14.18 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.309 178.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.5 172.13 13.15 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 -178.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 26.5 mm -84.42 -76.03 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . 0.4 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . 179.34 151.67 0.52 Allowed Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.616 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . 0.405 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 15.9 Cg_exo -68.92 -16.27 40.95 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.215 1.943 . . . . 0.0 110.649 172.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . 0.405 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 2.6 m-85 74.15 145.8 0.11 Allowed Pre-proline 0 C--N 1.34 0.158 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.214 177.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . 0.45 ' HB3' HD12 ' A' ' 110' ' ' LEU . 37.9 Cg_endo -67.23 115.32 3.6 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.306 2.004 . . . . 0.0 111.76 177.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -134.4 175.08 9.84 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.689 -177.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -100.32 135.58 41.54 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . 0.427 ' HB3' HG21 ' A' ' 94' ' ' ILE . . . -85.97 -102.99 0.06 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 175.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' A' ' 412' ' ' LEU . 17.2 mt -132.3 139.89 36.26 Favored Pre-proline 0 C--N 1.321 -0.655 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 174.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -53.75 133.46 54.32 Favored 'Trans proline' 0 C--O 1.236 0.388 0 C-N-CA 122.783 2.322 . . . . 0.0 112.218 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 5.7 m -58.33 141.39 51.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.518 -178.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . 0.434 ' O ' ' HD3' ' A' ' 417' ' ' PRO . 0.8 OUTLIER -72.83 76.26 1.14 Allowed 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 171.944 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 76.9 t60 -82.94 109.56 17.68 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.265 -177.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . 0.434 ' HD3' ' O ' ' A' ' 415' ' ' SER . 99.0 Cg_endo -82.12 -28.29 2.04 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 122.561 2.174 . . . . 0.0 112.869 -177.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.853 -0.594 . . . . 0.0 111.337 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.654 0 N-CA-C 112.213 -0.355 . . . . 0.0 112.213 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.35 109.95 2.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.067 0.461 . . . . 0.0 111.869 -177.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -131.37 22.85 4.78 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.175 177.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.454 ' H ' HG13 ' A' ' 78' ' ' ILE . 0.1 OUTLIER -106.8 106.36 20.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.544 -177.542 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.641 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER -176.25 -26.57 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.637 177.136 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.569 HD11 ' H ' ' A' ' 84' ' ' SER . 0.4 OUTLIER -108.13 -178.97 3.76 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.035 -174.213 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -80.66 81.65 6.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.727 175.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 114.27 -134.56 11.83 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.774 -0.727 . . . . 0.0 111.315 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.432 ' HA ' HD21 ' A' ' 80' ' ' LEU . 53.1 p-10 -152.29 35.33 0.52 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.125 0.488 . . . . 0.0 110.822 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.569 ' H ' HD11 ' A' ' 80' ' ' LEU . 0.3 OUTLIER -106.62 -113.69 0.27 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.058 -179.613 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . 0.521 ' H ' ' HB2' ' A' ' 84' ' ' SER . . . -88.08 124.76 7.32 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.81 -176.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.447 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -140.16 160.53 39.75 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 177.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.87 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 42.2 t -78.55 145.17 34.98 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.432 0.634 . . . . 0.0 111.288 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.02 -11.51 50.19 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.935 177.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -107.58 -50.36 3.08 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.938 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 28.1 m -82.48 -54.36 5.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.449 0.643 . . . . 0.0 109.736 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.87 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 102.56 -10.37 56.13 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.153 -173.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -69.05 146.4 52.68 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 176.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.64 144.31 57.02 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.04 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.518 HG12 HG11 ' A' ' 100' ' ' VAL . 5.7 mt -93.72 118.6 67.44 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.237 178.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 94' ' ' ILE . 3.0 Cg_exo -77.21 144.56 23.51 Favored 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 122.998 2.465 . . . . 0.0 112.181 178.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.535 ' HB2' ' HB3' ' A' ' 413' ' ' PRO . . . -77.42 -6.34 53.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.2 0.524 . . . . 0.0 110.604 178.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.41 16.98 25.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.676 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -131.98 162.84 29.73 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.121 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' A' ' 409' ' ' GLU . 6.3 mt -106.69 116.06 31.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.167 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.518 HG11 HG12 ' A' ' 94' ' ' ILE . 4.5 m -119.37 150.82 21.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.156 -174.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.506 ' HB2' ' O ' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -92.51 152.88 19.41 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.316 179.764 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.447 ' HB3' HG12 ' A' ' 107' ' ' VAL . 0.0 OUTLIER -153.9 159.78 41.89 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.855 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -122.4 -162.28 0.99 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.553 -178.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.72 12.08 2.82 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.163 -178.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -137.34 -81.3 0.1 OUTLIER Glycine 0 N--CA 1.442 -0.935 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.526 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -106.52 175.44 5.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.8 0.333 . . . . 0.0 111.754 -174.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.447 HG12 ' HB3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -108.31 149.83 11.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.126 -177.57 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . 0.492 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 32.2 m-85 -141.77 -168.72 2.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.254 -179.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.76 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 74.6 m80 -110.58 -157.42 0.61 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 172.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -86.17 -23.17 26.63 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.907 0.384 . . . . 0.0 111.266 176.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.41 -36.99 15.15 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.791 -174.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.76 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -74.58 -13.06 60.61 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.234 -174.375 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -79.23 64.2 4.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.33 0.586 . . . . 0.0 109.996 175.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -125.17 154.88 40.85 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.483 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.425 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 12.5 t -62.91 135.93 57.57 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.258 0.552 . . . . 0.0 110.68 176.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 2.4 m -81.88 -17.5 47.06 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.697 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.32 -51.34 4.63 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -176.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 14.6 p -114.14 -7.09 13.05 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.379 -174.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.425 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 76.76 13.01 2.32 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.001 176.662 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -63.68 118.36 8.16 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 174.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.01 122.68 17.93 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 177.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.7 HD13 ' HD2' ' A' ' 128' ' ' PHE . 11.4 mt -68.08 127.22 32.08 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.339 179.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.5 ' HB ' ' CB ' ' A' ' 126' ' ' ASP . 71.0 t -107.61 134.12 20.14 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -172.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -55.82 109.95 0.49 Allowed 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 122.032 1.821 . . . . 0.0 111.018 175.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.37 6.5 56.58 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.507 -175.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.5 ' CB ' ' HB ' ' A' ' 123' ' ' VAL . 27.3 t0 -121.89 173.94 7.19 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 122.643 -0.328 . . . . 0.0 110.566 178.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.577 ' HB2' ' HG3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -65.34 140.82 58.7 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.22 0.533 . . . . 0.0 112.335 -176.569 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.7 ' HD2' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -156.64 170.26 22.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.404 -0.817 . . . . 0.0 108.844 177.516 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -146.16 137.48 24.66 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.692 0.282 . . . . 0.0 110.683 176.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -125.03 100.92 6.8 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.77 HG21 HG23 ' A' ' 146' ' ' ILE . 7.1 mm -120.13 104.35 15.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.147 -177.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.1 t30 56.54 55.83 6.13 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.545 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 63.9 33.08 86.28 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.36 -0.837 . . . . 0.0 113.243 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.438 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 1.2 m -131.84 132.83 44.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -178.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.524 ' HB3' HD11 ' A' ' 122' ' ' LEU . 38.2 mt -91.88 116.98 29.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.345 0.593 . . . . 0.0 111.107 -177.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.438 ' CE2' ' HB2' ' A' ' 134' ' ' SER . 61.4 m-85 -128.18 -179.47 5.02 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.238 -0.892 . . . . 0.0 108.712 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . 0.721 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 10.3 p -129.25 -178.91 4.85 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.036 0.446 . . . . 0.0 110.659 176.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.577 ' HG3' ' HB2' ' A' ' 127' ' ' ARG . 1.4 mm-40 -79.13 -14.19 59.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.387 179.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . 0.721 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 71.2 t60 -70.97 -47.22 60.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.26 0.552 . . . . 0.0 109.643 -178.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.52 29.73 5.9 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.571 175.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.567 ' HD2' ' H ' ' A' ' 206' ' ' SER . 14.5 ttp180 -22.64 99.22 0.06 OUTLIER Pre-proline 0 N--CA 1.474 0.725 0 C-N-CA 125.812 1.645 . . . . 0.0 113.9 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.413 ' HG3' ' CG ' ' A' ' 136' ' ' PHE . 46.4 Cg_endo -97.55 73.31 0.09 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.915 0 C-N-CA 123.449 2.766 . . . . 0.0 112.989 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -111.41 169.98 8.43 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.142 -0.349 . . . . 0.0 111.247 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . 65.66 -84.21 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.484 0.714 . . . . 0.0 111.206 178.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -93.05 20.82 6.36 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 176.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.77 HG23 HG21 ' A' ' 131' ' ' ILE . 5.7 mt 53.49 39.81 0.31 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.738 -171.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -173.13 113.12 0.23 Allowed 'General case' 0 C--O 1.232 0.172 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.104 -178.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 76.4 77.76 0.74 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.779 -0.724 . . . . 0.0 113.027 178.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -63.3 121.94 25.68 Favored Glycine 0 N--CA 1.452 -0.295 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 174.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -40.1 -66.91 0.27 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.712 0.805 . . . . 0.0 111.948 -178.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . -119.4 -161.46 11.65 Favored Glycine 0 CA--C 1.504 -0.651 0 N-CA-C 110.065 -1.214 . . . . 0.0 110.065 172.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -67.07 87.48 0.14 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.446 -0.883 . . . . 0.0 111.324 175.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . 0.567 ' H ' ' HD2' ' A' ' 141' ' ' ARG . 1.4 m -56.6 -39.42 73.55 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 120.904 0.383 . . . . 0.0 110.644 -174.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 82.85 110.06 0.48 Allowed Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.521 -0.763 . . . . 0.0 114.385 169.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . 0.64 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 68.7 m -156.45 138.3 14.33 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 171.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 46.5 mm -118.89 137.08 54.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.539 0.209 . . . . 0.0 110.576 -174.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . 0.476 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -75.23 134.48 73.87 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.125 -178.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 14.7 Cg_exo -70.3 -178.67 2.67 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 123.482 2.788 . . . . 0.0 112.458 177.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -97.95 157.92 33.75 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.333 -177.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . 0.448 ' HB3' ' SD ' ' A' ' 101' ' ' MET . 97.1 Cg_endo -87.51 121.04 1.55 Allowed 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.719 2.279 . . . . 0.0 112.054 172.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . 0.409 ' HA ' HD22 ' A' ' 99' ' ' LEU . 0.0 OUTLIER -137.99 178.08 7.39 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.297 178.043 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -62.25 149.75 41.02 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.095 0.474 . . . . 0.0 111.458 179.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -136.32 -145.23 0.21 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.575 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 4.4 tp -73.01 128.18 88.3 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.733 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . 0.535 ' HB3' ' HB2' ' A' ' 96' ' ' ALA . 9.9 Cg_exo -72.17 168.96 22.67 Favored 'Trans proline' 0 CA--C 1.532 0.4 0 C-N-CA 123.095 2.53 . . . . 0.0 113.668 -175.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 90.8 m -92.49 133.08 36.27 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.594 178.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 69.4 m 59.98 -102.69 0.14 Allowed 'General case' 0 CA--C 1.533 0.294 0 O-C-N 123.329 0.393 . . . . 0.0 111.255 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -125.23 133.74 25.12 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -76.87 55.36 4.89 Favored 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 122.766 2.311 . . . . 0.0 112.734 -178.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . 0.469 ' HG3' ' H ' ' A' ' 418' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.882 0 CA-C-O 118.834 -0.603 . . . . 0.0 110.311 176.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.577 0 N-CA-C 111.897 -0.481 . . . . 0.0 111.897 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.0 m -134.75 169.44 17.33 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 -177.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -110.82 142.12 43.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.826 0.346 . . . . 0.0 111.025 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 30.8 mm -75.91 136.33 25.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.553 176.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.804 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 39.1 ttp180 -131.58 -42.55 1.04 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.481 0.657 . . . . 0.0 110.784 -176.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.47 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -82.15 127.02 32.72 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.348 178.13 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -66.83 105.17 1.51 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.471 ' O ' ' HB2' ' A' ' 83' ' ' ASN . . . 94.93 -94.26 1.73 Allowed Glycine 0 N--CA 1.442 -0.964 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 -172.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 82' ' ' GLY . 5.0 t-20 170.24 167.48 0.06 Allowed 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 177.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.7 m 71.03 -60.94 0.5 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 172.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . 0.401 ' O ' ' HA ' ' A' ' 93' ' ' SER . . . -79.69 71.86 2.64 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.37 -172.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.47 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -148.18 170.78 17.11 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 122.293 0.237 . . . . 0.0 110.381 179.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.81 145.78 30.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.999 0.428 . . . . 0.0 110.231 -179.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.37 -8.31 55.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.892 -0.595 . . . . 0.0 112.542 -172.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.711 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -88.65 -54.11 4.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.642 0.258 . . . . 0.0 111.453 -176.187 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 31.5 p -98.28 -39.84 8.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.063 0.459 . . . . 0.0 110.509 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.804 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 96.77 8.74 56.91 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-N 115.652 -0.703 . . . . 0.0 112.223 -178.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.547 ' HA ' HE21 ' A' ' 92' ' ' GLN . 1.1 tp60 -89.24 155.62 19.28 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.781 0.324 . . . . 0.0 110.321 177.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.509 ' HB3' ' HB ' ' A' ' 414' ' ' THR . 13.9 m -71.39 160.27 33.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.472 -174.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 23.3 mt -101.14 111.23 63.2 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.219 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.73 148.0 22.31 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 123.021 2.481 . . . . 0.0 111.3 172.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.94 -11.78 61.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.037 0.446 . . . . 0.0 111.594 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.85 1.0 57.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.26 0.552 . . . . 0.0 110.797 179.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.07 175.38 5.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.912 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.648 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 32.0 mt -124.11 133.17 53.67 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.694 0.283 . . . . 0.0 110.337 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -115.96 142.29 29.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.364 0.602 . . . . 0.0 110.6 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 5.1 mmt -85.56 113.98 22.22 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.788 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -99.44 121.93 41.83 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.203 -178.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -104.71 -83.34 0.5 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.769 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 6.9 mp0 -123.64 60.2 1.1 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.24 0.543 . . . . 0.0 110.279 -179.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 87.65 -17.37 45.12 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.105 -179.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -92.38 157.94 16.34 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 177.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -131.81 144.01 38.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.994 0.426 . . . . 0.0 111.745 -175.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . 0.409 ' HD1' ' HB2' ' A' ' 89' ' ' ALA . 92.9 m-85 -138.7 165.96 25.61 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 175.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.832 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 30.6 m80 -87.44 168.92 12.68 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.482 178.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' A' ' 110' ' ' LEU . 0.4 OUTLIER -62.58 -31.22 72.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.247 0.546 . . . . 0.0 110.983 177.906 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.459 ' H ' ' HG2' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.48 -20.78 23.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.905 179.388 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.832 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 35.3 m -91.27 -4.13 56.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.624 -174.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . 0.557 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.1 OUTLIER -85.16 91.83 8.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.952 0.406 . . . . 0.0 110.553 178.025 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.595 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.7 OUTLIER -146.43 156.19 43.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.237 -177.288 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.549 ' HB2' ' HB3' ' A' ' 137' ' ' CYS . 0.0 OUTLIER -70.82 152.64 43.52 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 169.501 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 1.4 p -93.21 -22.01 19.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -174.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.2 -51.05 4.56 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -172.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.701 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -101.57 -8.69 21.65 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.522 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.4 OUTLIER 62.78 44.75 6.21 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.429 -179.772 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . 0.492 ' H ' ' HB3' ' A' ' 115' ' ' CYS . 44.3 t30 -80.44 118.55 22.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.597 176.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.595 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.9 OUTLIER -69.58 108.04 3.66 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 177.719 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.441 ' H ' ' HG ' ' A' ' 122' ' ' LEU . 0.6 OUTLIER -70.8 129.06 38.11 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.688 -179.669 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.2 t -145.26 146.71 31.37 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.778 -173.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.79 111.69 0.76 Allowed 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.63 2.22 . . . . 0.0 111.635 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.22 -19.77 13.09 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.338 -0.705 . . . . 0.0 111.338 -176.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.423 ' CG ' ' H ' ' A' ' 127' ' ' ARG . 9.6 t70 -101.93 -152.82 0.44 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 175.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.423 ' H ' ' CG ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -121.56 155.19 35.55 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.765 0.317 . . . . 0.0 110.815 -174.2 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.546 ' CE2' ' HB2' ' A' ' 130' ' ' TYR . 0.2 OUTLIER -157.61 143.31 17.31 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.655 174.3 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . 0.466 ' HE2' ' CD ' ' A' ' 138' ' ' GLU . 51.7 m-70 -121.33 122.81 40.67 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.831 0.348 . . . . 0.0 110.078 178.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.546 ' HB2' ' CE2' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -119.82 101.77 8.11 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 178.813 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.646 HD11 HD12 ' A' ' 146' ' ' ILE . 1.5 mt -108.52 103.21 15.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.13 -178.027 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.1 t30 58.17 28.5 16.58 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.803 177.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.409 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 92.75 30.17 9.93 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.354 -0.927 . . . . 0.0 112.775 -179.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -125.9 126.63 44.72 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 176.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.427 HD22 ' CD1' ' A' ' 122' ' ' LEU . 14.6 mt -91.66 115.7 28.27 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -174.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -136.38 179.01 6.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.461 176.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . 0.652 ' SG ' ' HB2' ' A' ' 139' ' ' HIS . 1.1 p -137.84 179.19 6.57 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.719 0.295 . . . . 0.0 110.792 176.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.466 ' CD ' ' HE2' ' A' ' 129' ' ' HIS . 6.8 mm-40 -73.72 -16.07 61.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.284 -176.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . 0.652 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 0.2 OUTLIER -78.43 -11.07 59.93 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.698 0.285 . . . . 0.0 110.885 -176.644 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.701 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 10.4 p-10 -127.82 -47.37 1.39 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.225 177.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.408 ' HD3' HG21 ' A' ' 146' ' ' ILE . 0.0 OUTLIER 46.77 68.43 3.47 Favored Pre-proline 0 N--CA 1.47 0.569 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 172.89 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.44 ' HD3' ' OD2' ' A' ' 140' ' ' ASP . 66.1 Cg_endo -94.6 -172.99 0.29 Allowed 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 122.884 2.389 . . . . 0.0 112.837 178.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . 0.421 ' C ' ' H ' ' A' ' 145' ' ' LEU . 5.8 m 75.26 121.83 0.04 OUTLIER 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.226 -176.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -75.5 39.95 0.17 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.148 0.499 . . . . 0.0 111.023 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.421 ' H ' ' C ' ' A' ' 143' ' ' THR . 1.9 mt -162.69 27.06 0.1 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.093 -179.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.646 HD12 HD11 ' A' ' 131' ' ' ILE . 3.0 tt -78.88 -15.82 13.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.088 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 72.47 159.98 0.22 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.109 -0.951 . . . . 0.0 111.913 177.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -89.54 100.69 2.69 Favored Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.627 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -82.49 179.69 53.05 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.794 -0.717 . . . . 0.0 111.894 179.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -75.31 81.52 2.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.086 0.47 . . . . 0.0 110.947 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 66.61 -105.1 1.2 Allowed Glycine 0 N--CA 1.448 -0.518 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.293 179.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -118.35 28.88 6.65 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.927 -0.654 . . . . 0.0 111.771 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 2.5 m -137.58 65.77 1.48 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.193 0.52 . . . . 0.0 110.68 176.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -70.21 -42.13 67.47 Favored Glycine 0 N--CA 1.449 -0.465 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.897 176.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 40.6 m -155.52 136.16 13.42 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.941 0.4 . . . . 0.0 110.582 177.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 15.0 mm -93.85 136.16 26.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.232 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . 0.47 ' HA ' ' CD1' ' A' ' 128' ' ' PHE . . . -60.72 143.0 91.41 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.311 -178.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . 0.557 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 71.9 Cg_endo -74.68 -164.35 0.22 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.723 2.282 . . . . 0.0 112.541 179.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -117.07 146.07 37.17 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.086 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . 0.648 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 74.1 Cg_endo -77.1 125.52 7.98 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 122.551 2.167 . . . . 0.0 112.267 178.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -130.33 152.75 49.4 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.55 178.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -77.1 110.68 11.96 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.085 0.469 . . . . 0.0 110.376 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -93.85 -135.52 0.18 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.074 -178.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.497 ' H ' ' HG ' ' A' ' 412' ' ' LEU . 0.1 OUTLIER -81.22 129.26 67.52 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 179.508 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -78.83 164.98 24.97 Favored 'Trans proline' 0 C--O 1.237 0.47 0 C-N-CA 122.654 2.236 . . . . 0.0 112.586 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.509 ' HB ' ' HB3' ' A' ' 93' ' ' SER . 4.1 t -75.55 164.7 26.07 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.972 179.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.2 m -70.29 134.77 48.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.635 177.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 37.6 m80 -69.15 126.93 93.12 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-O 120.878 0.37 . . . . 0.0 110.064 179.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.53 173.4 4.46 Favored 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 123.063 2.509 . . . . 0.0 113.995 -174.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . 0.454 ' HG3' ' H ' ' A' ' 418' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.03 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.949 -175.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.614 0 N-CA-C 112.228 -0.349 . . . . 0.0 112.228 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.8 m 56.97 59.41 3.48 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 122.805 0.442 . . . . 0.0 111.68 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -134.41 120.92 20.41 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.18 177.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -128.19 129.28 69.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.621 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.08 18.42 6.58 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.163 175.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.707 HD21 ' HB ' ' A' ' 414' ' ' THR . 0.3 OUTLIER -162.58 158.23 23.11 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.096 -179.414 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -62.59 -63.77 1.12 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.082 178.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -96.85 9.46 65.99 Favored Glycine 0 C--O 1.229 -0.19 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.402 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.54 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 5.2 t-20 61.01 94.49 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.482 0.658 . . . . 0.0 111.958 -178.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.436 ' HB2' HG22 ' A' ' 414' ' ' THR . 0.7 OUTLIER -146.82 -146.15 0.19 Allowed 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 177.498 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -77.54 108.78 2.67 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.457 -0.878 . . . . 0.0 111.97 176.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.655 ' HB2' HD12 ' A' ' 80' ' ' LEU . . . -110.52 150.57 28.72 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.815 0.341 . . . . 0.0 111.381 -176.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -73.39 128.57 35.87 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 175.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.59 -5.39 47.54 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.638 -172.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.489 ' CB ' ' HB3' ' A' ' 112' ' ' CYS . . . -84.64 -46.93 11.02 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 121.039 -0.264 . . . . 0.0 110.738 -177.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.544 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 31.2 p -110.18 -74.65 0.64 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.192 -178.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.544 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 134.81 7.07 2.14 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 111.476 -0.649 . . . . 0.0 111.476 -176.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -73.88 131.45 41.5 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.059 0.457 . . . . 0.0 110.436 178.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.494 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 1.4 m -69.03 121.18 16.13 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.839 175.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.6 mp -74.89 113.52 25.51 Favored Pre-proline 0 C--N 1.326 -0.427 0 O-C-N 123.62 0.575 . . . . 0.0 112.287 -172.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.494 ' HD3' ' O ' ' A' ' 93' ' ' SER . 5.6 Cg_exo -80.56 167.49 18.93 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 123.407 2.738 . . . . 0.0 110.879 167.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.68 -1.47 24.93 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.056 0.455 . . . . 0.0 111.063 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.62 -29.09 22.82 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.071 178.258 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -85.97 173.89 9.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.502 -178.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.485 ' HB2' HD22 ' A' ' 110' ' ' LEU . 25.5 mt -125.73 128.77 48.28 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.592 -178.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.08 147.74 30.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.99 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 1.9 mtt -105.14 155.55 18.91 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.44 177.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 93.0 mtm-85 -112.6 98.69 7.41 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.677 0.275 . . . . 0.0 110.331 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -79.95 -36.36 36.31 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.121 0.486 . . . . 0.0 110.42 178.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.484 ' HB2' ' H ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -152.63 -127.45 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.675 178.69 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.484 ' H ' ' HB2' ' A' ' 104' ' ' GLN . . . -78.08 -26.31 60.28 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.741 -0.742 . . . . 0.0 111.853 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -103.27 162.31 13.1 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.937 0.399 . . . . 0.0 110.297 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 2.4 m -103.39 160.56 4.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.423 -176.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -137.29 143.1 41.98 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.634 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 7.6 m80 -69.27 161.87 28.36 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.871 0.367 . . . . 0.0 111.581 -177.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.485 HD22 ' HB2' ' A' ' 99' ' ' LEU . 0.3 OUTLIER -67.34 -27.63 67.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.231 0.538 . . . . 0.0 109.99 173.226 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.6 -23.19 22.01 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.738 178.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.634 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 63.6 m -94.77 -18.71 21.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.379 -176.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . 0.465 ' HD1' ' HA ' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -67.5 82.75 0.16 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.578 0.704 . . . . 0.0 110.508 177.029 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.604 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.5 p -135.47 160.99 36.73 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.693 -178.015 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.436 ' SG ' ' N ' ' A' ' 119' ' ' ARG . 26.2 p -72.73 149.94 43.3 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.349 0.595 . . . . 0.0 111.078 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -87.77 -2.27 58.51 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.455 179.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.575 ' HB ' ' SG ' ' A' ' 118' ' ' CYS . 0.8 OUTLIER -90.41 -54.68 3.9 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.65 -177.884 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.682 ' SG ' ' HB2' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -123.75 -20.9 5.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.231 -172.481 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.439 ' HB2' ' O ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER 81.02 50.97 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 123.812 0.845 . . . . 0.0 111.288 -179.289 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -97.32 151.65 19.69 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 169.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.604 ' HA ' HG22 ' A' ' 114' ' ' THR . 1.1 ttm180 -86.15 130.14 34.62 Favored 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.005 -176.297 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.419 HD13 ' HB2' ' A' ' 128' ' ' PHE . 16.0 mt -77.25 158.42 30.27 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 173.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -134.39 139.12 31.83 Favored Pre-proline 0 C--N 1.325 -0.476 0 C-N-CA 119.967 -0.693 . . . . 0.0 111.35 -169.046 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.437 ' HB3' ' HD3' ' A' ' 408' ' ' PRO . 11.7 Cg_endo -55.68 121.63 10.3 Favored 'Trans proline' 0 N--CA 1.463 -0.314 0 C-N-CA 123.075 2.516 . . . . 0.0 111.874 177.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 91.0 -2.06 78.81 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.438 -0.887 . . . . 0.0 112.331 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -112.26 -179.2 3.61 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 177.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.511 ' HG2' HD13 ' A' ' 404' ' ' ILE . 1.3 mtt85 -88.78 149.14 23.57 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.417 0.627 . . . . 0.0 112.314 -171.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.419 ' HB2' HD13 ' A' ' 122' ' ' LEU . 0.6 OUTLIER -148.91 145.58 27.48 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 175.721 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . 0.57 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 60.8 m-70 -115.31 121.65 43.52 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.76 0.314 . . . . 0.0 110.915 -175.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.501 ' HA ' ' O ' ' A' ' 134' ' ' SER . 1.4 t80 -112.58 100.78 8.99 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 174.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.489 ' HB ' ' CE2' ' A' ' 136' ' ' PHE . 8.4 mt -124.04 124.01 67.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.198 -175.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 61.1 33.96 19.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.237 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 69.39 35.1 75.4 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.409 -0.814 . . . . 0.0 112.869 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.501 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.8 OUTLIER -131.67 154.24 49.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.798 0.299 . . . . 0.0 110.359 -178.046 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 13.2 mt -96.54 114.59 26.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.497 -177.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.57 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 30.9 m-85 -120.43 157.26 29.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.343 0.592 . . . . 0.0 110.414 179.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . 0.562 ' HB2' ' H ' ' A' ' 140' ' ' ASP . 0.5 OUTLIER -92.55 152.41 19.64 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.921 -175.233 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.428 ' OE1' ' HD2' ' A' ' 127' ' ' ARG . 16.8 tp10 -80.37 -24.83 39.5 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.731 0.776 . . . . 0.0 108.909 161.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -81.54 -52.55 7.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.931 -171.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.682 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -114.94 34.39 4.86 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -178.322 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.481 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 9.9 ttp-105 -48.4 129.38 13.23 Favored Pre-proline 0 N--CA 1.464 0.27 0 CA-C-N 114.323 -1.308 . . . . 0.0 112.511 -173.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 21.2 Cg_exo -66.03 141.4 63.92 Favored 'Trans proline' 0 C--O 1.235 0.358 0 C-N-CA 122.829 2.353 . . . . 0.0 112.086 178.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.11 -3.9 57.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.558 -179.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -97.55 -74.14 0.58 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.808 -176.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.496 ' H ' ' HG ' ' A' ' 145' ' ' LEU . 0.0 OUTLIER -84.12 85.77 7.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.922 0.392 . . . . 0.0 111.08 -176.159 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -143.12 138.39 26.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.991 176.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -87.55 45.77 1.31 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.193 0.52 . . . . 0.0 110.558 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 106.13 147.07 14.51 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.285 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -118.67 41.13 2.09 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.679 -0.772 . . . . 0.0 111.815 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.43 31.37 0.74 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.084 0.468 . . . . 0.0 111.366 -178.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 80.34 -74.67 2.31 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.657 178.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -83.07 37.89 2.71 Favored Glycine 0 N--CA 1.453 -0.192 0 C-N-CA 121.218 -0.515 . . . . 0.0 113.446 -174.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.35 -20.29 21.23 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.978 0.418 . . . . 0.0 110.192 176.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -105.04 171.85 19.26 Favored Glycine 0 N--CA 1.446 -0.684 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.183 178.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.43 -176.15 2.91 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.137 0.494 . . . . 0.0 111.316 -176.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . 0.511 HD13 ' HG2' ' A' ' 127' ' ' ARG . 10.7 mm -111.38 135.54 50.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 176.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -59.5 113.21 6.53 Favored Pre-proline 0 C--N 1.329 -0.309 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 177.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . 0.466 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 83.7 Cg_exo -45.64 -72.78 0.04 OUTLIER 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.655 2.904 . . . . 0.0 112.819 -172.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . 0.466 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 1.1 t80 168.95 139.28 0.05 OUTLIER Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.147 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . 0.437 ' HD3' ' HB3' ' A' ' 124' ' ' PRO . 73.1 Cg_endo -85.87 107.13 0.9 Allowed 'Trans proline' 0 N--CA 1.446 -1.323 0 C-N-CA 122.22 1.947 . . . . 0.0 110.907 171.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -129.81 168.98 15.74 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.428 -175.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -77.22 111.12 12.51 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.203 177.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -89.2 -168.63 2.23 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.966 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.428 ' H ' ' HG ' ' A' ' 412' ' ' LEU . 0.1 OUTLIER -64.68 121.17 71.71 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.27 179.408 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -57.26 127.48 25.77 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.773 2.315 . . . . 0.0 111.815 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.707 ' HB ' HD21 ' A' ' 80' ' ' LEU . 34.0 p -85.3 161.13 19.65 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.567 -175.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.1 m 64.92 -149.06 0.26 Allowed 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.038 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -127.56 92.78 42.17 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -69.87 135.65 30.73 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.834 2.356 . . . . 0.0 112.356 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.26 -0.876 . . . . 0.0 109.757 178.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.481 0 N-CA-C 111.839 -0.504 . . . . 0.0 111.839 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.69 -173.99 3.59 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 62.54 44.97 6.55 Favored 'General case' 0 N--CA 1.463 0.205 0 O-C-N 123.517 0.511 . . . . 0.0 110.815 177.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.479 ' H ' HG13 ' A' ' 78' ' ' ILE . 0.0 OUTLIER -100.27 93.87 3.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.25 178.846 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 48.1 ttt85 -75.3 -22.17 57.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.939 -174.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.685 ' HB3' ' HA ' ' A' ' 83' ' ' ASN . 6.5 mp -83.97 10.76 9.07 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.586 -175.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.406 ' C ' ' H ' ' A' ' 83' ' ' ASN . 0.3 OUTLIER 49.28 84.48 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.558 0 O-C-N 123.803 0.69 . . . . 0.0 111.805 177.039 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.08 -16.98 19.35 Favored Glycine 0 C--O 1.228 -0.253 0 C-N-CA 120.306 -0.95 . . . . 0.0 111.083 -174.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.685 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 1.8 t30 71.11 54.39 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 123.654 0.781 . . . . 0.0 111.3 175.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.68 -58.44 1.88 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.565 177.215 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -155.38 142.82 9.23 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.615 -0.803 . . . . 0.0 112.382 -178.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.519 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . . . -154.24 171.11 19.74 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.517 ' HB2' ' HA ' ' A' ' 108' ' ' TYR . 0.1 OUTLIER -95.76 145.04 25.63 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.1 m -82.01 6.37 16.35 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -174.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.642 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -96.98 -59.59 1.76 Allowed 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.86 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.446 ' SG ' ' HB2' ' A' ' 92' ' ' GLN . 19.8 p -92.72 -36.76 12.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.85 0.357 . . . . 0.0 110.108 178.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 98.04 -3.37 60.29 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.487 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.446 ' HB2' ' SG ' ' A' ' 90' ' ' CYS . 0.0 OUTLIER -81.18 159.14 24.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.937 0.398 . . . . 0.0 110.612 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.24 164.82 17.45 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.651 -173.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 17.5 mt -113.83 99.83 50.97 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.807 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -77.04 159.68 33.79 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.589 2.193 . . . . 0.0 111.243 174.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -70.07 -10.07 57.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.132 0.491 . . . . 0.0 111.125 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.51 -13.32 52.21 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.002 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -117.25 147.78 42.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.977 -178.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.633 ' HB2' ' HB2' ' A' ' 408' ' ' PRO . 1.0 OUTLIER -108.43 141.6 40.05 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.857 -179.657 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -115.59 139.66 40.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.139 0.495 . . . . 0.0 111.125 -177.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.19 122.1 28.89 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.659 177.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.482 HH21 ' CD ' ' A' ' 409' ' ' GLU . 0.0 OUTLIER -113.75 142.16 46.39 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.219 -178.649 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -118.48 -76.54 0.57 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.531 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.508 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 0.2 OUTLIER -90.64 -93.64 0.13 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 177.145 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.508 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -120.16 0.16 13.01 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.4 175.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -103.07 163.67 12.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.746 0.307 . . . . 0.0 110.821 -177.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.2 m -134.91 148.12 29.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.329 -178.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . 0.517 ' HA ' ' HB2' ' A' ' 87' ' ' CYS . 6.1 m-85 -138.67 146.59 41.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.68 177.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.933 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 54.2 m80 -72.33 168.74 17.73 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.442 HD21 ' HG3' ' A' ' 408' ' ' PRO . 0.3 OUTLIER -63.02 -31.85 73.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.207 0.527 . . . . 0.0 110.939 178.887 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.475 ' HG3' ' SG ' ' A' ' 112' ' ' CYS . 3.4 pttp -89.35 0.65 56.66 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.05 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.933 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 4.6 m -117.41 -10.1 10.76 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.557 -176.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.6 69.68 2.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.549 0.69 . . . . 0.0 110.251 176.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.749 HG22 ' HA ' ' A' ' 121' ' ' ARG . 19.7 p -138.71 153.45 48.51 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.152 -0.931 . . . . 0.0 109.425 -178.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.488 ' HB3' ' HA ' ' A' ' 136' ' ' PHE . 3.6 p -71.89 153.2 42.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.059 0.457 . . . . 0.0 110.673 179.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -84.15 -8.02 59.2 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.063 0.459 . . . . 0.0 110.727 178.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.16 -51.11 5.76 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.925 -178.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.61 -6.45 10.19 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.487 -177.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.453 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 61.78 35.86 16.51 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.063 0.459 . . . . 0.0 110.551 -179.272 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . 0.636 HD22 ' HB2' ' A' ' 137' ' ' CYS . 49.2 t30 -80.95 131.61 35.34 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.643 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.749 ' HA ' HG22 ' A' ' 114' ' ' THR . 1.1 tpp85 -72.65 115.42 11.9 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.97 -178.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.475 HD13 ' HD2' ' A' ' 128' ' ' PHE . 5.6 mt -74.97 139.62 43.09 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 177.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -131.28 133.23 24.29 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-O 120.704 0.287 . . . . 0.0 111.603 -169.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -60.9 113.23 1.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.481 2.12 . . . . 0.0 110.538 171.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 120.21 -22.59 8.4 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 110.748 -0.941 . . . . 0.0 110.748 -173.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.01 -175.46 2.69 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.445 ' HB3' ' HG2' ' A' ' 138' ' ' GLU . 8.7 ttm-85 -99.07 148.37 24.11 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.849 0.357 . . . . 0.0 111.159 -173.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.475 ' HD2' HD13 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -143.2 156.76 44.83 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.508 176.366 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . 0.6 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 4.6 m-70 -117.39 117.89 30.72 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.001 0.429 . . . . 0.0 110.517 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.457 ' HA ' ' O ' ' A' ' 134' ' ' SER . 16.3 t80 -118.75 101.67 8.26 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 176.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -124.62 113.75 37.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.574 -177.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 7.0 t30 56.67 41.07 28.87 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.226 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 75.04 33.48 54.65 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.748 -0.739 . . . . 0.0 113.019 177.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.457 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.6 OUTLIER -126.98 145.45 50.7 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.828 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 79.1 mt -101.35 124.46 47.07 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 123.339 0.399 . . . . 0.0 110.967 -176.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.6 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 76.4 m-85 -135.95 164.4 28.06 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.613 175.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . 0.636 ' HB2' HD22 ' A' ' 120' ' ' ASN . 30.9 p -113.55 -167.23 1.17 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.28 0.562 . . . . 0.0 111.844 -175.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.445 ' HG2' ' HB3' ' A' ' 127' ' ' ARG . 1.3 mt-10 -75.36 -30.08 60.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.261 176.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . 0.481 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 77.6 t60 -73.84 -30.87 62.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.113 177.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.578 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.9 OUTLIER -66.47 -80.89 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.095 175.182 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.598 HH21 ' HA2' ' A' ' 205' ' ' GLY . 0.0 OUTLIER 48.97 59.65 16.78 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.362 -177.919 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.551 ' HD3' ' HB3' ' A' ' 140' ' ' ASP . 37.6 Cg_endo -66.01 92.37 0.26 Allowed 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.849 2.366 . . . . 0.0 112.03 -175.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . 0.442 ' HA ' HG12 ' A' ' 146' ' ' ILE . 0.2 OUTLIER -76.23 58.86 1.31 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.371 -178.529 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -125.68 -65.88 0.97 Allowed 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.469 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -115.73 43.06 2.17 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.076 0.465 . . . . 0.0 110.266 179.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.442 HG12 ' HA ' ' A' ' 143' ' ' THR . 0.1 OUTLIER -74.52 152.98 6.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.833 -179.799 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -81.02 77.25 7.94 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.022 0.439 . . . . 0.0 111.056 -177.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 96.14 -61.6 1.31 Allowed Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.814 176.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 87.41 -102.3 2.77 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.36 -177.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 1.1 m 58.62 39.6 24.45 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.63 0.372 . . . . 0.0 111.795 174.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 118.54 -116.28 3.35 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.725 178.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . 0.598 ' HA2' HH21 ' A' ' 141' ' ' ARG . . . -90.92 67.68 2.37 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.767 -177.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.01 142.27 54.23 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.757 0.313 . . . . 0.0 111.048 177.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 121.65 127.44 3.38 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 121.002 -0.618 . . . . 0.0 111.634 -177.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -92.62 167.42 11.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.92 0.39 . . . . 0.0 110.686 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 46.9 mm -76.19 130.14 36.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -56.67 130.77 77.71 Favored Pre-proline 0 C--N 1.33 -0.247 0 O-C-N 123.337 0.398 . . . . 0.0 111.346 -177.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.78 162.07 30.01 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.851 2.368 . . . . 0.0 112.169 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -88.45 152.69 50.05 Favored Pre-proline 0 C--N 1.319 -0.758 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.043 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . 0.633 ' HB2' ' HB2' ' A' ' 99' ' ' LEU . 51.2 Cg_endo -70.27 126.62 13.17 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 122.161 1.907 . . . . 0.0 111.758 176.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . 0.482 ' CD ' HH21 ' A' ' 102' ' ' ARG . 2.6 mt-10 -127.0 160.7 30.32 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.465 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -79.5 123.52 27.64 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.651 -0.499 . . . . 0.0 109.651 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -103.38 -106.3 0.28 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.22 -177.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.78 117.23 37.8 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.42 131.94 26.07 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.578 2.186 . . . . 0.0 112.773 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 19.2 m -56.36 142.0 39.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.045 -0.98 . . . . 0.0 111.084 174.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 11.1 m -98.38 155.23 17.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.107 -176.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . 0.449 ' HA ' ' HD3' ' A' ' 417' ' ' PRO . 59.7 m80 -70.36 142.89 89.98 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.165 -0.47 . . . . 0.0 109.929 176.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 416' ' ' HIS . 3.5 Cg_exo -74.3 72.88 4.04 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 123.259 2.639 . . . . 0.0 112.644 -176.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.383 -0.818 . . . . 0.0 110.103 177.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.662 0 N-CA-C 111.475 -0.65 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -58.01 3.29 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.751 0.31 . . . . 0.0 111.427 -178.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -141.38 171.96 13.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.864 0.364 . . . . 0.0 111.047 -177.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 5.0 mt -87.61 107.5 17.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.32 -177.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.8 mtp85 -131.38 8.95 4.69 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.954 175.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.612 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 1.4 pt? -121.01 -179.43 4.02 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.494 -169.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -105.81 141.81 36.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.224 175.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.64 -40.95 2.99 Favored Glycine 0 CA--C 1.517 0.2 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.616 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.598 ' HA ' HD21 ' A' ' 80' ' ' LEU . 2.3 t-20 81.75 33.76 0.1 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.637 0.775 . . . . 0.0 112.198 175.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.449 ' N ' HD11 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -130.25 66.99 1.48 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.282 177.032 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 117.65 98.18 1.95 Allowed Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.459 -0.877 . . . . 0.0 113.093 175.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.612 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -138.33 156.47 47.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.144 0.497 . . . . 0.0 110.838 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 4.6 t -70.4 146.57 50.31 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.392 178.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.94 8.54 39.36 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.525 172.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.453 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -120.94 -59.62 1.72 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.453 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.487 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 30.3 p -93.09 -77.61 0.44 Allowed 'General case' 0 C--O 1.233 0.207 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.541 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.487 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 145.84 -3.03 1.08 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.642 -0.789 . . . . 0.0 113.142 176.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.9 tp60 -63.89 128.39 35.59 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 117.275 0.538 . . . . 0.0 110.616 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.857 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.7 OUTLIER -56.34 120.79 8.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.804 -0.634 . . . . 0.0 109.54 172.389 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.401 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 5.1 mt -75.89 113.39 26.83 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 112.224 0.454 . . . . 0.0 112.224 -172.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.677 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 5.7 Cg_exo -78.19 167.68 22.9 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.373 2.715 . . . . 0.0 111.083 172.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.19 -2.87 26.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.86 0.362 . . . . 0.0 111.16 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.93 8.38 34.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.954 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.677 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 1.6 mm-40 -119.03 134.54 55.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.885 177.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.543 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 1.4 mt -100.82 136.63 40.37 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.061 0.458 . . . . 0.0 110.342 -178.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 1.6 m -115.37 136.5 51.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.718 -179.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.461 ' SD ' ' HG3' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -84.26 123.42 30.12 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.068 -179.446 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 13.2 ptt85 -90.24 121.46 32.28 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.103 -177.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -105.13 -27.35 11.65 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.922 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -179.41 -128.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.811 -178.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -78.33 -8.29 87.57 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.567 -0.825 . . . . 0.0 111.252 173.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 28.5 m-20 -102.93 142.05 34.7 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 177.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -126.49 141.54 45.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.005 0.431 . . . . 0.0 110.896 -177.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -129.29 172.77 11.15 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 177.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.795 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 13.9 m80 -85.17 170.73 12.59 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 177.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.416 ' HA ' ' SD ' ' A' ' 101' ' ' MET . 0.3 OUTLIER -69.63 -23.54 63.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.32 0.581 . . . . 0.0 109.521 173.578 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.485 ' HG2' ' HB3' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -90.25 -18.75 25.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.409 176.469 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.795 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 55.6 m -100.78 7.39 43.81 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.241 0.543 . . . . 0.0 111.06 -176.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . 0.453 ' HD1' ' HA ' ' A' ' 113' ' ' PHE . 0.1 OUTLIER -89.69 73.06 7.68 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.3 0.571 . . . . 0.0 110.273 177.84 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.628 HG22 ' HA ' ' A' ' 121' ' ' ARG . 15.2 p -133.48 155.7 49.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.145 -179.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 26.8 p -73.21 153.49 40.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.048 0.451 . . . . 0.0 110.816 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.49 2.16 42.3 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.977 -176.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -109.05 -51.63 2.86 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -179.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.95 -10.5 13.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.899 0.381 . . . . 0.0 110.941 -177.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 58.84 35.53 24.28 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.201 -177.006 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -73.87 120.8 19.96 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 174.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.628 ' HA ' HG22 ' A' ' 114' ' ' THR . 3.6 ttm180 -66.83 124.91 24.25 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.986 0.422 . . . . 0.0 110.749 -178.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.744 HD22 ' HB2' ' A' ' 128' ' ' PHE . 1.7 mt -76.75 158.91 30.58 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.138 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.547 ' O ' ' HB3' ' A' ' 405' ' ' ALA . 71.9 t -126.51 132.12 24.19 Favored Pre-proline 0 C--N 1.327 -0.41 0 C-N-CA 121.096 -0.241 . . . . 0.0 110.415 -172.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.06 111.39 0.89 Allowed 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.705 2.27 . . . . 0.0 111.096 175.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 93.49 17.09 43.53 Favored Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 120.568 -0.825 . . . . 0.0 111.793 -177.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -133.8 -176.17 4.08 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.815 0.34 . . . . 0.0 111.031 176.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -75.35 127.12 32.43 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.439 -172.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.744 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -145.62 165.72 27.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 172.593 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 136' ' ' PHE . 0.6 OUTLIER -131.19 128.67 40.46 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.719 -0.613 . . . . 0.0 111.822 -178.194 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.462 ' HB2' ' CZ ' ' A' ' 128' ' ' PHE . 1.7 t80 -125.58 101.07 6.73 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 56.2 mt -110.22 103.81 16.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.192 -177.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.7 t30 53.64 38.91 29.38 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.686 0.617 . . . . 0.0 111.262 -178.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.406 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 85.63 21.46 53.64 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.65 -0.786 . . . . 0.0 113.297 177.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -113.76 134.06 54.99 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 117.201 0.501 . . . . 0.0 109.769 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.416 ' HA ' HD23 ' A' ' 135' ' ' LEU . 14.5 mt -88.64 115.25 26.03 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.937 0.399 . . . . 0.0 111.23 -176.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.55 ' HB2' ' HB3' ' A' ' 129' ' ' HIS . 63.9 m-85 -131.09 168.18 17.85 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.554 176.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . 0.654 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 24.9 p -113.78 -169.65 1.55 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.204 0.525 . . . . 0.0 110.854 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.65 -28.97 51.43 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.99 177.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -77.83 -28.28 50.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.493 0.663 . . . . 0.0 109.517 178.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.654 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.4 OUTLIER -67.18 -82.15 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.313 174.657 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 42.46 73.33 0.94 Allowed Pre-proline 0 C--O 1.237 0.438 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.964 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.554 ' O ' ' HB ' ' A' ' 146' ' ' ILE . 50.4 Cg_exo -55.41 100.91 0.08 OUTLIER 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.758 2.305 . . . . 0.0 111.711 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.61 56.49 3.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.825 -173.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -158.72 -78.1 0.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.558 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.505 ' HA ' HD22 ' A' ' 145' ' ' LEU . 0.1 OUTLIER -89.01 71.73 8.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.436 0.636 . . . . 0.0 109.562 175.576 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.571 HG12 ' H ' ' A' ' 201' ' ' GLY . 11.5 tt -122.94 159.99 26.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.234 -176.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -80.46 -17.46 51.62 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.883 0.373 . . . . 0.0 110.48 177.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . 0.571 ' H ' HG12 ' A' ' 146' ' ' ILE . . . 168.02 126.35 0.84 Allowed Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.704 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . 0.417 ' O ' ' HB3' ' A' ' 206' ' ' SER . . . -91.0 -28.49 15.25 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.538 -0.839 . . . . 0.0 111.85 177.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.46 -52.61 2.03 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.97 0.414 . . . . 0.0 110.296 177.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . -79.15 105.0 2.18 Favored Glycine 0 N--CA 1.45 -0.39 0 N-CA-C 110.352 -1.099 . . . . 0.0 110.352 171.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 72.71 51.64 11.21 Favored Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 -170.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . 0.417 ' HB3' ' O ' ' A' ' 202' ' ' GLY . 0.0 OUTLIER -64.34 -5.53 5.33 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -172.853 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 170.81 173.77 38.21 Favored Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 121.018 -0.611 . . . . 0.0 112.183 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -113.61 134.19 54.86 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.917 0.389 . . . . 0.0 110.2 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 38.5 mm -79.27 117.99 25.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 176.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 123' ' ' VAL . . . -59.94 132.79 89.61 Favored Pre-proline 0 C--O 1.235 0.34 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.321 -175.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . 0.521 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 2.8 Cg_exo -76.65 -170.81 0.96 Allowed 'Trans proline' 0 N--CA 1.462 -0.364 0 C-N-CA 123.663 2.909 . . . . 0.0 112.414 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -104.73 158.36 32.16 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.269 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . 0.543 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 5.8 Cg_exo -77.62 141.4 19.65 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.778 2.318 . . . . 0.0 112.086 178.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.32 177.28 7.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.291 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -104.28 121.1 42.63 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 178.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -84.8 -102.94 0.05 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.219 -178.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -131.74 130.89 22.44 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -68.01 145.33 67.27 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.132 1.888 . . . . 0.0 111.658 176.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.857 HG21 ' HB3' ' A' ' 93' ' ' SER . 0.1 OUTLIER -76.19 178.1 6.68 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.055 -176.196 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -74.48 166.58 23.29 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.099 178.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 48.7 m-70 -95.67 120.29 63.65 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.825 -176.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -86.83 5.81 5.64 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.719 2.279 . . . . 0.0 111.866 176.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 2.2 tpmp? . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.168 -0.92 . . . . 0.0 110.555 -179.954 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.837 0 N-CA-C 111.76 -0.536 . . . . 0.0 111.76 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.1 76.82 1.62 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.192 0.52 . . . . 0.0 111.236 -177.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -122.18 118.29 28.27 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 176.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -108.56 143.33 19.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.07 0.462 . . . . 0.0 110.905 -175.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.637 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER -85.77 74.66 10.18 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.807 177.147 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.717 HD21 ' HB ' ' A' ' 414' ' ' THR . 0.5 OUTLIER -144.76 -179.97 6.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.948 0.404 . . . . 0.0 111.281 -177.847 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -92.15 -60.56 1.82 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.219 177.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.536 ' HA3' ' HA ' ' A' ' 415' ' ' SER . . . -87.19 -1.89 83.82 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.185 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 60.92 93.42 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.342 0.591 . . . . 0.0 111.923 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.47 ' HB2' HG22 ' A' ' 414' ' ' THR . 0.6 OUTLIER -146.31 -76.78 0.19 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.475 178.733 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -148.1 127.05 2.48 Favored Glycine 0 N--CA 1.45 -0.391 0 N-CA-C 110.519 -1.033 . . . . 0.0 110.519 177.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -118.69 164.47 15.31 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.851 0.358 . . . . 0.0 111.296 -175.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 27.9 t -63.79 144.3 57.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.237 177.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.54 -8.16 58.47 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.297 -178.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.431 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -111.37 -33.69 6.34 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.08 -0.248 . . . . 0.0 111.148 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.486 ' SG ' ' NZ ' ' A' ' 111' ' ' LYS . 32.0 m -100.03 -79.2 0.5 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.552 0.691 . . . . 0.0 110.272 175.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.637 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 113.28 57.56 0.41 Allowed Glycine 0 N--CA 1.442 -0.958 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.767 -176.267 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -146.65 178.39 8.33 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 177.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.611 ' HA ' HD11 ' A' ' 80' ' ' LEU . 0.1 OUTLIER -76.29 160.48 29.59 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.383 0.611 . . . . 0.0 111.326 -177.524 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.658 HG12 HG11 ' A' ' 100' ' ' VAL . 2.8 mp -118.65 100.3 51.17 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.542 177.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.626 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 6.4 Cg_exo -75.41 167.78 25.93 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 123.238 2.626 . . . . 0.0 112.029 176.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.84 -16.01 60.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.88 -177.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.07 -17.24 29.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.955 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.626 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 12.6 mp0 -100.42 147.82 25.43 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.338 -177.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.403 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 21.9 mt -103.97 141.72 35.68 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.031 0.443 . . . . 0.0 111.088 -176.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.658 HG11 HG12 ' A' ' 94' ' ' ILE . 0.9 OUTLIER -125.94 147.24 30.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.037 178.121 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.461 ' SD ' ' HA ' ' A' ' 110' ' ' LEU . 0.0 OUTLIER -97.94 112.59 24.46 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.007 0.432 . . . . 0.0 110.308 -179.215 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -82.51 113.12 20.03 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.472 -179.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -100.11 -45.51 5.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.675 178.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.451 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 4.9 mm-40 -154.76 -137.84 0.07 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.102 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.451 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -75.47 -9.59 84.54 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 120.951 -0.643 . . . . 0.0 112.293 179.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -105.24 160.58 14.98 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 176.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -118.66 139.4 46.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.209 0.528 . . . . 0.0 111.921 -174.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -131.48 168.32 17.84 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 174.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.822 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 73.9 m80 -94.53 -163.92 1.11 Allowed 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.461 ' HA ' ' SD ' ' A' ' 101' ' ' MET . 0.4 OUTLIER -84.03 -20.22 33.09 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.002 0.429 . . . . 0.0 110.977 177.153 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.486 ' NZ ' ' SG ' ' A' ' 90' ' ' CYS . 0.0 OUTLIER -89.79 -22.09 22.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.74 -175.263 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.822 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -94.45 -5.46 46.18 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.156 -173.548 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.63 74.54 4.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.358 0.599 . . . . 0.0 109.616 175.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.606 HG22 ' HG2' ' A' ' 121' ' ' ARG . 38.2 p -127.39 147.8 50.27 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.171 -179.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.57 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 7.6 p -71.38 146.58 48.66 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.17 0.509 . . . . 0.0 110.355 177.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.08 -1.79 57.25 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.378 -176.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.35 -51.25 3.69 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -175.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.624 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -119.52 -3.71 10.39 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 111.645 0.239 . . . . 0.0 111.645 -175.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 70.61 38.98 1.2 Allowed 'General case' 0 C--O 1.233 0.221 0 O-C-N 123.847 0.717 . . . . 0.0 110.6 179.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -78.91 128.29 33.11 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.917 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.606 ' HG2' HG22 ' A' ' 114' ' ' THR . 0.2 OUTLIER -78.64 109.08 12.52 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 178.468 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.523 HD22 ' HB2' ' A' ' 128' ' ' PHE . 6.4 mt -67.73 148.59 51.08 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.914 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -136.8 140.28 31.37 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.214 -170.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.718 ' HB3' ' HA ' ' A' ' 407' ' ' PHE . 13.5 Cg_endo -55.77 111.42 0.76 Allowed 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.943 2.428 . . . . 0.0 111.887 178.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 108.06 -15.47 36.65 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.311 -176.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -97.55 -179.24 4.4 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.814 ' HD3' ' HG3' ' A' ' 138' ' ' GLU . 0.1 OUTLIER -101.77 143.11 32.1 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.055 0.455 . . . . 0.0 111.462 -171.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.523 ' HB2' HD22 ' A' ' 122' ' ' LEU . 1.4 p90 -149.72 151.46 33.69 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.748 176.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . 0.637 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 59.9 m-70 -113.29 118.51 34.83 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.033 0.444 . . . . 0.0 110.88 -177.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' A' ' 134' ' ' SER . 23.5 t80 -108.36 101.35 10.55 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.932 -0.577 . . . . 0.0 109.879 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.473 HG21 ' O ' ' A' ' 145' ' ' LEU . 2.6 mt -130.64 132.41 64.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.771 179.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 55.7 t30 55.38 35.76 25.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.407 0.622 . . . . 0.0 110.449 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.407 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 67.36 35.93 88.33 Favored Glycine 0 N--CA 1.451 -0.365 0 CA-C-N 115.704 -0.68 . . . . 0.0 112.809 178.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.482 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 4.3 m -131.27 151.18 51.74 Favored 'General case' 0 CA--C 1.517 -0.318 0 O-C-N 122.677 -0.308 . . . . 0.0 110.294 -177.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.7 mt -101.94 121.32 41.91 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.714 -177.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.637 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 59.7 m-85 -126.51 172.27 10.36 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 175.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 8.9 p -125.24 177.49 6.1 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.727 0.298 . . . . 0.0 110.774 -179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.814 ' HG3' ' HD3' ' A' ' 127' ' ' ARG . 8.8 mm-40 -77.92 -13.52 59.86 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.013 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -78.14 -33.45 50.38 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.624 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 2.7 p30 -91.92 -48.08 6.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.279 176.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.452 HH11 ' HD2' ' A' ' 141' ' ' ARG . 0.0 OUTLIER 43.64 88.23 0.1 Allowed Pre-proline 0 N--CA 1.466 0.331 0 C-N-CA 124.118 0.967 . . . . 0.0 112.993 175.313 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -72.25 72.8 2.77 Favored 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 122.971 2.447 . . . . 0.0 112.041 178.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.41 55.81 0.82 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.469 0.652 . . . . 0.0 111.789 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -147.87 -56.75 0.23 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 175.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.473 ' O ' HG21 ' A' ' 131' ' ' ILE . 0.2 OUTLIER -90.34 71.87 7.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.78 174.721 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -140.73 138.53 35.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.346 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -79.33 66.59 4.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.449 178.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 67.11 33.22 82.67 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 121.156 -0.545 . . . . 0.0 111.854 -177.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 82.12 98.5 0.46 Allowed Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 -176.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -49.42 117.26 2.1 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -174.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 82.34 -37.41 2.58 Favored Glycine 0 C--N 1.333 0.41 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.724 177.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 159.48 46.6 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 110.105 -1.198 . . . . 0.0 110.105 -178.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 16.9 m 60.54 45.69 10.35 Favored 'General case' 0 C--N 1.333 -0.137 0 O-C-N 124.297 0.645 . . . . 0.0 110.756 -174.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 140.43 101.61 0.48 Allowed Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.882 -179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.48 155.91 20.34 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 47.7 mm -110.0 134.97 50.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.466 -178.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -68.98 121.81 82.93 Favored Pre-proline 0 C--N 1.328 -0.348 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 175.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -57.54 -90.99 0.0 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.125 2.55 . . . . 0.0 112.905 -175.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . 0.718 ' HA ' ' HB3' ' A' ' 124' ' ' PRO . 0.2 OUTLIER -171.78 150.9 2.68 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -178.833 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . 0.605 ' HD2' ' CD1' ' A' ' 407' ' ' PHE . 47.8 Cg_endo -72.7 111.25 3.2 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 121.761 1.64 . . . . 0.0 110.723 168.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -120.38 170.36 9.44 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.358 -173.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -92.1 109.96 21.32 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 176.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -84.11 -94.09 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.216 -176.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.408 ' HA ' ' HD2' ' A' ' 413' ' ' PRO . 0.3 OUTLIER -131.24 126.32 21.37 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.895 -177.175 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 412' ' ' LEU . 21.8 Cg_endo -62.99 125.03 15.04 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.613 2.209 . . . . 0.0 111.292 173.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.717 ' HB ' HD21 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -107.42 162.35 14.0 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.039 -176.06 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . 0.536 ' HA ' ' HA3' ' A' ' 82' ' ' GLY . 14.1 m 63.77 -151.58 0.31 Allowed 'General case' 0 C--O 1.235 0.291 0 O-C-N 123.568 0.542 . . . . 0.0 110.686 -178.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . 0.42 ' HA ' ' HD3' ' A' ' 417' ' ' PRO . 2.7 m-70 -112.27 141.01 24.28 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 174.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 416' ' ' HIS . 34.2 Cg_exo -60.57 -47.79 12.89 Favored 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.876 2.384 . . . . 0.0 112.861 -177.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.448 -0.787 . . . . 0.0 110.518 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.868 0 N-CA-C 111.807 -0.517 . . . . 0.0 111.807 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 m -86.46 107.08 17.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.23 0.538 . . . . 0.0 110.322 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -80.09 -33.09 39.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.283 -177.057 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 1.5 tt -122.54 122.96 67.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 121.507 0.67 . . . . 0.0 111.923 -175.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -146.61 6.12 0.93 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.603 171.197 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.681 HD12 ' HA ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -96.16 112.98 24.55 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.213 -173.094 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -61.05 -38.75 87.28 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.705 0.764 . . . . 0.0 109.179 175.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -100.83 111.79 4.24 Favored Glycine 0 N--CA 1.441 -0.974 0 N-CA-C 109.855 -1.298 . . . . 0.0 109.855 168.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.681 ' HA ' HD12 ' A' ' 80' ' ' LEU . 0.8 OUTLIER -71.68 12.72 0.33 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -170.051 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.602 ' HB2' ' HB3' ' A' ' 412' ' ' LEU . 0.1 OUTLIER -82.0 -37.12 27.07 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.604 0.24 . . . . 0.0 110.869 178.269 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 176.67 170.11 38.82 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.927 -0.654 . . . . 0.0 111.859 -177.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.508 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -162.45 171.36 17.23 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.946 0.373 . . . . 0.0 110.814 -178.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.526 ' HB2' ' CE1' ' A' ' 109' ' ' HIS . 42.1 t -73.16 145.86 46.04 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.911 178.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.13 -6.96 59.49 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.997 0.427 . . . . 0.0 110.505 175.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -113.04 -49.89 2.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.067 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 26.9 m -84.4 -28.08 27.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.049 0.452 . . . . 0.0 110.604 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.97 25.9 75.01 Favored Glycine 0 N--CA 1.451 -0.341 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.947 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -115.38 142.08 47.17 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.491 -0.188 . . . . 0.0 110.491 -178.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.7 m -65.55 157.74 28.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.143 176.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.72 ' O ' ' HA ' ' A' ' 413' ' ' PRO . 3.4 mp -113.12 116.69 46.74 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.477 -172.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.455 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 6.2 Cg_exo -75.52 165.95 29.52 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 122.925 2.417 . . . . 0.0 111.192 171.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.72 -16.65 61.66 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.34 0.59 . . . . 0.0 110.505 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.18 -14.77 59.32 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.093 177.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.455 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -109.64 159.57 17.01 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.184 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.3 mt -120.97 146.8 46.29 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.511 0.672 . . . . 0.0 110.931 -176.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.746 HG21 ' HB2' ' A' ' 411' ' ' ALA . 13.9 m -119.76 179.28 2.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.96 -178.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 2.1 mmt -134.09 122.38 22.84 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 174.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.4 105.38 12.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.049 0.452 . . . . 0.0 110.973 -175.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.402 ' HB2' ' HE1' ' A' ' 113' ' ' PHE . . . -88.25 66.75 8.55 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.866 179.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 55.7 47.36 20.69 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.368 178.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 130.74 -59.63 0.69 Allowed Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.407 178.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -89.99 170.31 10.47 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 122.886 -0.185 . . . . 0.0 110.553 -178.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -127.33 134.01 66.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.515 0.674 . . . . 0.0 112.42 -174.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -116.79 179.13 4.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 169.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.878 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 72.8 m80 -94.99 -164.29 1.15 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 176.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.6 tp -79.16 -23.03 44.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.949 0.404 . . . . 0.0 110.9 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.437 ' HG2' ' H ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.35 -38.29 13.45 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.253 0.549 . . . . 0.0 111.35 -176.759 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.878 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.26 -17.66 59.37 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.388 -175.472 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . 0.402 ' HE1' ' HB2' ' A' ' 103' ' ' ALA . 0.1 OUTLIER -72.16 77.02 0.96 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.592 0.711 . . . . 0.0 110.327 176.883 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.752 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.9 OUTLIER -145.6 164.05 32.9 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.083 -177.224 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.501 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 19.9 p -77.97 152.56 33.08 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 120.25 -0.58 . . . . 0.0 109.858 176.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.9 5.61 50.72 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.236 0.541 . . . . 0.0 110.722 -179.127 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.1 -50.77 3.55 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.804 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.94 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -113.53 -13.06 12.82 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 120.701 0.286 . . . . 0.0 111.064 178.183 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.501 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 65.45 39.36 5.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.38 -177.602 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -86.44 133.16 33.79 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 176.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.752 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.0 OUTLIER -70.32 109.77 4.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.33 -179.01 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.566 HD13 ' HB2' ' A' ' 128' ' ' PHE . 19.8 mt -63.9 149.95 46.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.415 178.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.55 ' HB ' ' CB ' ' A' ' 126' ' ' ASP . 21.6 t -110.23 130.75 22.52 Favored Pre-proline 0 C--N 1.321 -0.636 0 C-N-CA 120.314 -0.554 . . . . 0.0 110.962 -167.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.48 ' HB3' ' HA ' ' A' ' 407' ' ' PHE . 17.9 Cg_endo -58.93 111.5 0.91 Allowed 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.843 2.362 . . . . 0.0 111.046 174.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 92.6 13.75 56.44 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.23 -177.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.55 ' CB ' ' HB ' ' A' ' 123' ' ' VAL . 1.4 t70 -133.09 -172.93 3.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.599 0.238 . . . . 0.0 110.755 178.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.21 136.55 57.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.059 -0.518 . . . . 0.0 112.31 -174.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.566 ' HB2' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -157.13 144.97 19.1 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.359 -0.837 . . . . 0.0 108.852 172.85 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . 0.546 ' O ' ' HA ' ' A' ' 135' ' ' LEU . 66.0 m-70 -118.6 125.99 50.98 Favored 'General case' 0 C--N 1.319 -0.744 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.752 -178.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.477 ' HB2' ' CE2' ' A' ' 128' ' ' PHE . 83.7 t80 -125.4 101.3 6.88 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -128.84 120.45 52.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.343 -177.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.5 t30 59.92 32.75 21.34 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.135 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 74.63 33.29 56.14 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.671 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -133.99 131.76 39.32 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.546 ' HA ' ' O ' ' A' ' 129' ' ' HIS . 6.1 mp -98.93 133.98 42.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.501 -176.424 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.447 ' HA ' ' CB ' ' A' ' 115' ' ' CYS . 21.0 m-85 -136.85 166.03 24.58 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.544 178.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 16.4 p -109.27 -168.45 1.34 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.913 0.387 . . . . 0.0 110.839 178.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -77.64 -26.71 50.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.472 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -73.55 -42.31 61.85 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.563 -175.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.94 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 0.6 OUTLIER -101.19 -2.17 32.0 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.469 -176.59 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 141' ' ' ARG . 32.0 ttt-85 -29.69 105.61 0.22 Allowed Pre-proline 0 N--CA 1.478 0.931 0 O-C-N 124.517 1.136 . . . . 0.0 113.336 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -79.06 88.78 1.42 Allowed 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 123.242 2.628 . . . . 0.0 112.301 178.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.52 -30.67 61.12 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.485 -0.779 . . . . 0.0 112.708 -176.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -75.08 -15.77 60.6 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -175.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 145' ' ' LEU . 1.0 OUTLIER -91.87 -22.39 20.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.818 0.342 . . . . 0.0 111.222 -175.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -114.36 160.29 13.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.562 -177.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -85.47 62.57 7.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.437 0.637 . . . . 0.0 109.432 178.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 73.58 6.38 71.02 Favored Glycine 0 N--CA 1.452 -0.282 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.944 -176.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 72.28 -97.69 0.78 Allowed Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -175.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 58.6 p -125.65 11.7 7.92 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.203 0.525 . . . . 0.0 109.772 174.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 81.02 52.11 4.45 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 -174.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 143.14 -42.82 1.06 Allowed Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 111.289 -0.725 . . . . 0.0 111.289 -176.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -129.45 -152.23 0.51 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . 0.414 ' HA3' ' CE1' ' A' ' 129' ' ' HIS . . . -135.45 -106.22 0.85 Allowed Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 111.066 -0.814 . . . . 0.0 111.066 176.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -116.2 169.52 9.22 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 173.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 50.9 mm -114.44 126.13 71.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 123' ' ' VAL . . . -66.87 134.87 94.09 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.909 -177.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 20.0 Cg_exo -67.01 -176.19 0.73 Allowed 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 123.082 2.521 . . . . 0.0 111.715 176.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . 0.48 ' HA ' ' HB3' ' A' ' 124' ' ' PRO . 27.6 m-85 -107.94 163.46 16.91 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.942 -179.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -54.35 116.78 3.3 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 122.551 2.167 . . . . 0.0 111.704 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -115.7 177.53 4.64 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.123 -176.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -116.6 121.81 42.79 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 174.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . 0.746 ' HB2' HG21 ' A' ' 100' ' ' VAL . . . -90.88 -141.35 0.17 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.875 0.369 . . . . 0.0 111.244 -176.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.602 ' HB3' ' HB2' ' A' ' 84' ' ' SER . 0.0 OUTLIER -90.96 113.25 57.49 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.136 -179.41 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . 0.72 ' HA ' ' O ' ' A' ' 94' ' ' ILE . 14.6 Cg_endo -57.77 151.04 58.59 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.997 2.465 . . . . 0.0 113.173 -178.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 3.2 m -71.17 129.82 39.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.265 -178.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.44 106.95 1.52 Allowed 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 174.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 417' ' ' PRO . 17.8 m170 -77.91 137.5 61.83 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.962 -175.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 416' ' ' HIS . 24.2 Cg_exo -63.93 143.28 84.96 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.203 2.602 . . . . 0.0 112.677 -177.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 16.1 tttm . . . . . 0 C--O 1.248 0.998 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.382 -179.511 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.682 0 N-CA-C 111.486 -0.646 . . . . 0.0 111.486 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -140.77 154.58 46.34 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 -179.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -62.49 -52.7 62.47 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.269 0.557 . . . . 0.0 109.674 177.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -91.89 122.79 43.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.302 176.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.71 -32.66 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.153 -0.931 . . . . 0.0 108.576 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.587 HD23 ' H ' ' A' ' 80' ' ' LEU . 1.3 pt? -96.2 28.98 2.98 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.195 176.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.404 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.3 OUTLIER 52.64 74.69 0.27 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.99 -179.76 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 92.56 -125.63 8.21 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.222 -173.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.551 ' HA ' HD11 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -162.02 66.78 0.25 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.234 0.54 . . . . 0.0 110.4 178.914 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.38 -72.47 0.7 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.046 178.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -141.7 142.87 12.34 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 121.186 -0.531 . . . . 0.0 111.916 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -137.67 158.86 43.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.969 0.414 . . . . 0.0 110.91 -178.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.506 ' HB2' ' CE1' ' A' ' 109' ' ' HIS . 38.0 t -85.89 144.92 27.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.349 177.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.32 -4.0 58.6 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.882 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.422 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -117.11 -47.59 2.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.488 -179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 57.0 m -82.6 -40.64 20.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.852 0.358 . . . . 0.0 111.276 -179.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 85.57 9.16 79.23 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 110.814 -0.915 . . . . 0.0 110.814 -172.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.493 ' NE2' ' H ' ' A' ' 93' ' ' SER . 0.0 OUTLIER -93.88 164.7 13.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.366 -0.417 . . . . 0.0 109.953 179.213 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.493 ' H ' ' NE2' ' A' ' 92' ' ' GLN . 0.0 OUTLIER -82.03 171.28 14.57 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.059 0.457 . . . . 0.0 111.218 -179.831 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.763 HG12 HG11 ' A' ' 100' ' ' VAL . 2.6 mp -114.77 105.31 53.48 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.372 175.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -73.8 159.12 45.87 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.767 2.311 . . . . 0.0 112.076 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.52 ' HB2' ' HB3' ' A' ' 413' ' ' PRO . . . -71.91 -13.08 61.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.975 0.416 . . . . 0.0 111.118 -178.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.74 12.26 32.62 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.926 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -123.2 157.04 33.91 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.221 0.534 . . . . 0.0 110.718 -179.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.6 mt -114.68 130.03 56.76 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.314 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.763 HG11 HG12 ' A' ' 94' ' ' ILE . 13.2 m -129.66 168.06 23.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.773 -175.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -112.11 141.13 46.18 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.022 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.2 136.35 49.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.361 -178.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -150.97 121.83 7.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.684 -0.234 . . . . 0.0 110.998 179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 70.2 -2.64 2.04 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.162 0.585 . . . . 0.0 111.733 176.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 115.83 -16.09 16.29 Favored Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -175.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -89.97 163.92 14.76 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -124.4 140.21 48.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.034 0.445 . . . . 0.0 111.669 -177.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . 0.549 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 98.2 m-85 -131.09 167.49 19.01 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.366 -0.833 . . . . 0.0 108.771 175.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.798 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 72.5 m80 -92.73 -159.14 0.65 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 176.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 5.0 mt -85.29 -22.0 28.75 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.994 0.426 . . . . 0.0 111.37 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.63 -35.61 14.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.939 0.4 . . . . 0.0 111.763 -176.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.798 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.5 -16.66 59.59 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.207 -175.678 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.66 64.53 6.41 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.397 177.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.684 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.6 OUTLIER -131.14 152.47 50.4 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.774 -179.67 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.472 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 5.0 t -64.23 132.21 49.63 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 175.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 3.4 m -82.27 2.47 31.83 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.548 -176.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -106.03 -49.38 3.39 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -176.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.527 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 28.2 p -112.04 -14.42 13.45 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.055 0.455 . . . . 0.0 110.654 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.472 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 73.8 23.81 2.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.287 -179.034 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . 0.527 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 3.2 m-80 -65.88 133.63 51.33 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 170.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.684 ' HA ' HG22 ' A' ' 114' ' ' THR . 10.7 tpp85 -75.29 119.55 19.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.243 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.638 HD11 ' HB3' ' A' ' 135' ' ' LEU . 23.6 mt -58.89 137.19 57.93 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -115.27 132.38 23.09 Favored Pre-proline 0 C--N 1.321 -0.641 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.309 -165.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.47 ' HB2' ' CE2' ' A' ' 407' ' ' PHE . 19.9 Cg_endo -60.63 111.7 1.12 Allowed 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.628 2.219 . . . . 0.0 110.992 175.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 110.29 -4.48 29.89 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.604 -0.807 . . . . 0.0 112.045 -178.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.404 ' O ' ' HA ' ' A' ' 404' ' ' ILE . 1.0 OUTLIER -124.45 -177.76 3.9 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 177.203 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.521 ' HD2' ' HG3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -90.5 149.71 22.09 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.385 0.612 . . . . 0.0 112.348 -172.176 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.531 ' HB2' HD22 ' A' ' 122' ' ' LEU . 5.8 p90 -144.91 147.19 32.47 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.946 -1.025 . . . . 0.0 108.577 172.05 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -112.73 113.75 26.0 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.12 0.486 . . . . 0.0 110.973 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.488 ' CE2' ' HA2' ' A' ' 133' ' ' GLY . 3.8 t80 -92.66 101.1 13.5 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 175.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 28.1 mm -112.56 115.06 48.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.937 -176.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.5 t30 54.41 35.72 23.79 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 123.657 0.598 . . . . 0.0 111.288 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.488 ' HA2' ' CE2' ' A' ' 130' ' ' TYR . . . 80.24 30.11 42.88 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.938 177.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.417 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 0.7 OUTLIER -133.92 146.64 50.7 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.733 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.638 ' HB3' HD11 ' A' ' 122' ' ' LEU . 3.1 mt -95.37 118.98 33.08 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.865 0.364 . . . . 0.0 110.848 -177.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.417 ' CE2' ' HB2' ' A' ' 134' ' ' SER . 69.0 m-85 -126.85 159.66 33.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.939 176.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . 0.526 ' SG ' ' HB2' ' A' ' 140' ' ' ASP . 14.4 p -101.02 169.91 8.63 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.442 -178.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.521 ' HG3' ' HD2' ' A' ' 127' ' ' ARG . 1.5 mm-40 -77.9 -17.7 56.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.267 0.556 . . . . 0.0 110.264 174.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -20.76 58.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.622 0.725 . . . . 0.0 109.222 179.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.526 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 0.4 OUTLIER -104.07 -67.86 0.88 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.995 178.567 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 52.51 89.66 0.1 OUTLIER Pre-proline 0 N--CA 1.466 0.355 0 C-N-CA 123.468 0.707 . . . . 0.0 112.376 178.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -58.19 99.42 0.1 OUTLIER 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.047 2.498 . . . . 0.0 112.405 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.83 -26.64 63.37 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.96 -176.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.69 -39.84 95.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.774 -177.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.2 mt -152.28 90.87 1.54 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.501 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.476 ' H ' HG13 ' A' ' 146' ' ' ILE . 0.1 OUTLIER -99.66 46.36 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.956 -179.869 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -76.24 95.17 3.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.078 0.466 . . . . 0.0 110.322 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 159.68 -37.91 0.47 Allowed Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 110.659 -0.977 . . . . 0.0 110.659 -179.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -107.29 150.15 16.75 Favored Glycine 0 N--CA 1.45 -0.428 0 N-CA-C 111.598 -0.601 . . . . 0.0 111.598 176.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.37 19.33 1.25 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 121.177 0.513 . . . . 0.0 110.943 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 125.3 -93.8 0.44 Allowed Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 111.073 -0.811 . . . . 0.0 111.073 -176.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -132.7 47.94 0.98 Allowed Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 110.761 -0.936 . . . . 0.0 110.761 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.97 -38.53 88.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.891 0.377 . . . . 0.0 110.903 -178.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 84.32 80.4 1.06 Allowed Glycine 0 N--CA 1.442 -0.952 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.73 177.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -76.01 118.05 18.36 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 173.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . 0.404 ' HA ' ' O ' ' A' ' 126' ' ' ASP . 30.2 mm -81.54 138.95 18.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.938 -174.338 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -57.9 128.72 81.22 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.391 176.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . 0.606 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 38.1 Cg_endo -66.98 -5.46 13.56 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.383 2.722 . . . . 0.0 113.93 -174.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . 0.606 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 21.0 m-85 78.06 156.59 0.14 Allowed Pre-proline 0 N--CA 1.468 0.434 0 O-C-N 124.011 0.819 . . . . 0.0 109.935 -178.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -76.95 128.56 10.06 Favored 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.42 2.08 . . . . 0.0 112.203 176.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -140.44 177.21 8.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.585 176.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -86.29 125.63 33.74 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.784 0.326 . . . . 0.0 110.871 -179.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -91.92 -143.03 0.19 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.165 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 13.3 mt -85.35 116.55 66.01 Favored Pre-proline 0 N--CA 1.452 -0.369 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 177.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . 0.52 ' HB3' ' HB2' ' A' ' 96' ' ' ALA . 24.6 Cg_exo -63.75 154.82 67.18 Favored 'Trans proline' 0 C--O 1.237 0.453 0 C-N-CA 122.818 2.346 . . . . 0.0 112.84 -178.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.404 HG21 ' HB3' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -69.25 154.61 41.76 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.259 179.775 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 5.9 m -69.7 138.55 52.99 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.174 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . 0.49 ' HA ' ' HD3' ' A' ' 417' ' ' PRO . 17.5 t60 -72.75 114.26 28.75 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.167 177.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 416' ' ' HIS . 2.8 Cg_endo -80.05 58.56 7.04 Favored 'Trans proline' 0 C--O 1.237 0.429 0 C-N-CA 123.247 2.631 . . . . 0.0 112.625 -175.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.079 0 CA-C-O 117.97 -1.014 . . . . 0.0 109.799 175.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.874 0 N-CA-C 111.866 -0.493 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.431 ' HB2' HG13 ' A' ' 78' ' ' ILE . 0.0 OUTLIER -131.26 140.76 49.89 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.299 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 7.8 p90 -71.79 -19.53 61.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.818 0.342 . . . . 0.0 111.21 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.431 HG13 ' HB2' ' A' ' 2' ' ' SER . 0.6 OUTLIER -79.42 100.3 3.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.148 0.499 . . . . 0.0 110.728 178.482 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.456 ' HB3' ' HB1' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -97.4 6.48 48.17 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.534 0.683 . . . . 0.0 110.015 179.693 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.842 HD13 ' HA ' ' A' ' 83' ' ' ASN . 0.0 OUTLIER -121.56 113.71 20.17 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.607 -172.627 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -61.2 -35.56 77.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.32 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -124.3 26.43 5.79 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.149 -0.548 . . . . 0.0 111.963 179.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.842 ' HA ' HD13 ' A' ' 80' ' ' LEU . 2.7 t-20 69.41 161.73 0.21 Allowed 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.509 0.724 . . . . 0.0 112.801 178.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.447 ' N ' HD22 ' A' ' 80' ' ' LEU . 51.4 m 71.76 -61.15 0.5 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.008 -0.996 . . . . 0.0 113.46 174.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -89.23 122.2 6.36 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.547 -0.835 . . . . 0.0 113.22 -174.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.517 ' HA ' ' HA ' ' A' ' 93' ' ' SER . . . -168.29 133.42 1.76 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.578 0.228 . . . . 0.0 111.127 177.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.33 133.57 34.04 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 171.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.7 m -86.66 8.66 21.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.052 -0.522 . . . . 0.0 112.229 -172.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.722 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -98.17 -59.53 1.74 Allowed 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.082 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 26.1 p -86.42 -60.08 2.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.254 0.549 . . . . 0.0 110.609 -177.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.44 ' HA2' ' HE ' ' A' ' 79' ' ' ARG . . . 133.07 -2.8 4.79 Favored Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.739 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -82.19 122.24 27.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.902 0.382 . . . . 0.0 110.279 178.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.582 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.9 OUTLIER -63.13 128.03 33.96 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.809 172.833 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.442 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 1.7 mt -65.31 119.66 61.17 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.789 -174.266 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 94' ' ' ILE . 2.9 Cg_exo -76.88 166.9 26.17 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.25 2.633 . . . . 0.0 111.817 176.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.42 0.85 18.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.931 0.396 . . . . 0.0 111.499 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.18 21.39 14.22 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.875 179.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -135.88 160.31 38.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.739 179.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.1 mp -120.86 150.55 40.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.336 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.9 157.4 42.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.939 -178.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.0 126.78 52.6 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.078 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 102' ' ' ARG . 10.1 mtt-85 -91.48 97.77 11.27 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.412 ' HB2' ' CE1' ' A' ' 113' ' ' PHE . . . -64.68 -59.07 4.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.752 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.3 91.12 0.37 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.004 179.163 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 82.09 -52.69 4.66 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.012 -0.613 . . . . 0.0 112.292 -176.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -90.97 158.66 16.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.586 0.231 . . . . 0.0 111.285 -178.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -118.09 144.24 26.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.9 0.381 . . . . 0.0 111.072 -177.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -137.0 163.74 30.01 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.672 177.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.784 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 12.4 m80 -79.49 170.82 16.01 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.824 0.345 . . . . 0.0 110.773 -179.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.38 -31.61 72.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.821 177.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.535 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.48 -30.83 18.0 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.122 0.487 . . . . 0.0 110.551 178.609 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.784 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 34.0 m -79.0 -13.74 59.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.148 -178.131 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . 0.412 ' CE1' ' HB2' ' A' ' 103' ' ' ALA . 0.0 OUTLIER -76.18 76.03 3.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.091 174.053 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.576 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.7 OUTLIER -133.79 149.7 51.42 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.115 -178.425 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.444 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 5.5 p -74.53 155.16 38.22 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.142 0.496 . . . . 0.0 111.174 -179.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 1.5 m -79.68 -45.68 18.53 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.248 -175.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.74 -51.57 39.93 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -171.222 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.79 -14.65 16.53 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 121.051 -0.259 . . . . 0.0 111.196 -175.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.444 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 69.41 31.65 3.74 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.88 -176.819 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . 0.414 HD22 ' HB2' ' A' ' 137' ' ' CYS . 22.9 t30 -83.4 146.96 28.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.639 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.576 ' HA ' HG22 ' A' ' 114' ' ' THR . 9.0 ttt180 -85.84 135.47 33.7 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.879 0.371 . . . . 0.0 111.313 -175.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.732 HD22 ' HB2' ' A' ' 128' ' ' PHE . 9.0 mt -81.75 125.71 30.96 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 174.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 38.6 t -122.56 138.38 29.21 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.621 -170.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.43 111.41 0.93 Allowed 'Trans proline' 0 N--CA 1.463 -0.277 0 C-N-CA 122.406 2.07 . . . . 0.0 111.072 174.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 114.34 -21.36 15.06 Favored Glycine 0 N--CA 1.446 -0.641 0 N-CA-C 111.045 -0.822 . . . . 0.0 111.045 -173.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.47 176.02 5.49 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.746 ' HB2' ' HB2' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -102.46 135.83 43.38 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.703 0.287 . . . . 0.0 111.363 -173.807 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.732 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -132.52 159.6 38.95 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.027 179.322 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . 0.564 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 78.1 m-70 -130.09 140.58 50.8 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.774 0.321 . . . . 0.0 110.528 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.422 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 10.7 t80 -125.28 101.98 7.23 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 178.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 7.6 mt -121.84 111.33 30.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 120.732 0.301 . . . . 0.0 110.649 -176.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 51.7 t30 57.87 51.13 9.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.667 179.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.422 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 62.19 35.58 91.74 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.736 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 2.6 m -133.38 138.85 46.48 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -177.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 24.3 mt -92.67 125.34 37.25 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.975 -175.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.564 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 76.5 m-85 -129.43 161.96 29.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.055 176.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . 0.513 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 17.1 p -111.07 -176.14 2.88 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.953 0.406 . . . . 0.0 111.298 -175.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.746 ' HB2' ' HB2' ' A' ' 127' ' ' ARG . 0.0 OUTLIER -71.56 -32.94 68.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.871 176.661 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -68.11 -34.42 76.34 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 177.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.513 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.7 OUTLIER -66.35 -77.73 0.06 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.271 175.47 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 44.18 70.59 1.83 Allowed Pre-proline 0 CA--C 1.529 0.15 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.855 -176.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.4 ' O ' HG22 ' A' ' 146' ' ' ILE . 8.9 Cg_exo -72.09 78.66 1.81 Allowed 'Trans proline' 0 C--O 1.236 0.394 0 C-N-CA 122.762 2.308 . . . . 0.0 111.786 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 18.4 m -57.79 -41.2 81.63 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.993 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -71.62 -24.28 61.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.945 0.402 . . . . 0.0 111.45 -177.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -79.79 -52.66 7.64 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.1 -178.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.426 ' O ' HG13 ' A' ' 146' ' ' ILE . 0.8 OUTLIER -90.73 -22.79 6.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.728 -175.526 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 59.41 48.25 10.16 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.345 0.593 . . . . 0.0 110.795 -176.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 168.1 -92.12 0.1 Allowed Glycine 0 N--CA 1.453 -0.227 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.443 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 146.06 63.37 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 120.54 -0.838 . . . . 0.0 112.933 177.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 1.1 m 39.68 63.24 1.05 Allowed 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 176.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 91.92 -88.35 1.35 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.485 -0.864 . . . . 0.0 112.939 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -111.28 49.55 0.84 Allowed Glycine 0 N--CA 1.454 -0.114 0 C-N-CA 120.74 -0.743 . . . . 0.0 113.503 -173.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 3.4 m 60.35 28.1 17.71 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.063 0.458 . . . . 0.0 112.034 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 133.72 101.66 0.75 Allowed Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.98 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.48 144.91 28.42 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.866 0.365 . . . . 0.0 110.811 -178.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 28.4 mm -79.43 141.74 14.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 177.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . 0.462 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -50.25 127.06 22.24 Favored Pre-proline 0 N--CA 1.462 0.128 0 O-C-N 123.289 0.368 . . . . 0.0 111.025 177.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 15.3 Cg_exo -69.45 10.29 0.46 Allowed 'Trans proline' 0 N--CA 1.475 0.44 0 C-N-CA 123.733 2.956 . . . . 0.0 114.023 -171.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 15.1 m-85 70.34 158.54 0.16 Allowed Pre-proline 0 N--CA 1.466 0.355 0 O-C-N 123.554 0.534 . . . . 0.0 111.741 176.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -83.89 149.38 12.4 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.647 2.232 . . . . 0.0 112.915 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -155.13 160.74 41.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.441 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -78.19 124.59 28.25 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 176.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -94.45 -139.48 0.23 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.288 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.1 OUTLIER -91.45 111.79 50.86 Favored Pre-proline 0 C--N 1.329 -0.286 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 175.396 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 28.8 Cg_exo -61.75 132.18 38.88 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.512 2.141 . . . . 0.0 112.16 -179.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.582 HG21 ' HB3' ' A' ' 93' ' ' SER . 1.0 OUTLIER -70.64 139.03 51.22 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.407 -179.22 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . 0.412 ' O ' ' HD3' ' A' ' 417' ' ' PRO . 0.9 OUTLIER 71.73 152.99 0.12 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.777 0.831 . . . . 0.0 111.845 177.85 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 9.4 m170 -106.36 98.96 21.52 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.292 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 415' ' ' SER . 19.2 Cg_endo -91.72 24.99 0.5 Allowed 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.521 2.814 . . . . 0.0 112.605 -176.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.845 0 CA-C-O 118.781 -0.628 . . . . 0.0 109.832 -179.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.672 0 N-CA-C 112.298 -0.321 . . . . 0.0 112.298 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 m 54.25 50.9 15.4 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 123.372 0.669 . . . . 0.0 111.939 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -87.64 -30.91 20.08 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.138 0.494 . . . . 0.0 109.976 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 7.9 tt -158.07 129.99 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.646 179.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.0 ttt85 -151.21 33.03 0.58 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.31 0.576 . . . . 0.0 109.793 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.719 HD21 ' HA ' ' A' ' 83' ' ' ASN . 0.4 OUTLIER -154.76 -176.72 6.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.116 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -82.26 72.04 9.32 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.54 0.686 . . . . 0.0 110.067 176.52 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 125.29 -117.65 3.03 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.413 -178.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.719 ' HA ' HD21 ' A' ' 80' ' ' LEU . 1.4 t-20 -159.32 175.49 13.31 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 178.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 10.5 m 62.09 73.29 0.47 Allowed 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.88 0.737 . . . . 0.0 112.04 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . 0.505 ' HA3' HG22 ' A' ' 414' ' ' THR . . . 128.59 83.41 0.37 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.191 -1.004 . . . . 0.0 112.978 175.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.563 ' HB2' HD22 ' A' ' 80' ' ' LEU . . . -148.25 144.37 27.61 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.629 -0.336 . . . . 0.0 110.181 178.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 4.7 t -66.65 142.62 57.39 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.693 177.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.585 ' HB2' ' CE1' ' A' ' 108' ' ' TYR . 0.7 OUTLIER -95.13 8.37 43.21 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.677 174.637 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.706 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -118.42 -59.7 1.86 Allowed 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.622 -179.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.431 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 31.1 p -91.09 -73.97 0.52 Allowed 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.167 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.431 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 129.56 61.02 0.1 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.548 176.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.511 ' NE2' ' HA ' ' A' ' 92' ' ' GLN . 0.5 OUTLIER -137.52 150.51 47.58 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.6 0.238 . . . . 0.0 110.374 178.612 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.0 119.71 14.62 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.972 176.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.5 mp -76.54 120.23 80.79 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.785 -174.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.43 ' HD2' ' HB3' ' A' ' 98' ' ' GLU . 5.7 Cg_exo -77.74 166.24 25.69 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.524 2.816 . . . . 0.0 111.778 173.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.23 -21.05 61.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.962 0.411 . . . . 0.0 110.982 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.42 -13.66 58.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.282 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.43 ' HB3' ' HD2' ' A' ' 95' ' ' PRO . 15.1 tt0 -106.38 121.08 43.53 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.038 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 21.2 mt -84.75 139.3 32.07 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.552 -178.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.449 ' O ' ' HA ' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -115.09 144.59 22.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.945 -178.229 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.439 ' SD ' ' HG ' ' A' ' 110' ' ' LEU . 0.0 OUTLIER -91.81 120.26 32.36 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.993 179.965 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.513 ' HD2' HG13 ' A' ' 107' ' ' VAL . 8.3 tpt180 -96.74 108.76 21.46 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.034 -177.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -82.34 -40.22 21.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.055 0.455 . . . . 0.0 110.152 175.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.469 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -174.34 -106.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.582 176.747 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.469 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -76.69 -30.19 56.57 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.603 -0.808 . . . . 0.0 111.719 176.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -89.38 159.48 17.3 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.714 0.292 . . . . 0.0 110.974 -176.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.513 HG13 ' HD2' ' A' ' 102' ' ' ARG . 0.1 OUTLIER -128.99 135.91 60.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.834 -179.738 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . 0.585 ' CE1' ' HB2' ' A' ' 88' ' ' SER . 74.3 m-85 -135.92 164.79 27.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.445 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.843 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 19.4 m80 -92.32 172.33 8.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.537 179.169 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.667 HD21 ' HG3' ' A' ' 408' ' ' PRO . 0.5 OUTLIER -65.15 -30.96 71.92 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.341 0.591 . . . . 0.0 110.665 175.232 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.443 ' HG2' ' H ' ' A' ' 111' ' ' LYS . 2.4 pttt -90.11 -13.51 35.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.355 -0.838 . . . . 0.0 110.85 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.843 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 35.4 m -103.77 -20.76 13.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.126 -173.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . 0.529 ' HD1' ' HA ' ' A' ' 113' ' ' PHE . 0.0 OUTLIER -64.85 98.27 0.27 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.269 177.669 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.595 HG22 ' HA ' ' A' ' 121' ' ' ARG . 2.8 p -147.7 160.88 42.21 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -178.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 9.1 p -83.89 153.18 24.13 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 120.815 0.341 . . . . 0.0 110.296 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.16 -16.12 59.25 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.308 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.76 -51.05 5.71 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -173.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.797 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -112.85 -15.63 12.87 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.771 -0.371 . . . . 0.0 111.322 -178.024 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 67.69 36.31 3.68 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 123.624 0.577 . . . . 0.0 110.161 -176.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -73.81 123.51 24.32 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 175.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.595 ' HA ' HG22 ' A' ' 114' ' ' THR . 1.4 mtm180 -74.78 106.46 6.33 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.884 0.374 . . . . 0.0 110.744 -175.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.625 HD22 ' HB2' ' A' ' 128' ' ' PHE . 2.7 mt -66.1 133.94 51.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.007 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 14.8 t -132.85 142.28 44.13 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.695 -171.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_exo -57.09 109.56 0.47 Allowed 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 121.86 1.706 . . . . 0.0 110.72 173.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 117.39 -13.56 13.63 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.561 -174.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -108.29 169.04 8.88 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 175.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.507 ' HB2' ' HB3' ' A' ' 138' ' ' GLU . 8.6 mtt85 -100.49 145.61 28.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.958 0.409 . . . . 0.0 111.374 -174.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.625 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.4 OUTLIER -148.34 171.94 15.19 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.883 -179.799 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . 0.556 ' CD2' ' HG3' ' A' ' 141' ' ' ARG . 3.3 m-70 -140.92 139.62 34.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.042 0.449 . . . . 0.0 111.282 178.262 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.624 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 46.6 t80 -124.26 103.24 8.12 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.505 HD12 ' CD2' ' A' ' 136' ' ' PHE . 13.5 mt -115.56 105.35 18.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.258 -175.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 64.4 24.56 13.23 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.033 174.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.624 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 92.94 31.86 8.31 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.614 -179.316 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.14 138.93 45.55 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.481 HD23 ' HD1' ' A' ' 130' ' ' TYR . 21.9 mt -96.94 127.74 43.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.957 0.408 . . . . 0.0 111.643 -176.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.505 ' CD2' HD12 ' A' ' 131' ' ' ILE . 72.9 m-85 -135.0 160.9 36.84 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 173.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . 0.606 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 23.7 p -101.79 -171.76 2.03 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.193 0.521 . . . . 0.0 110.461 179.48 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.507 ' HB3' ' HB2' ' A' ' 127' ' ' ARG . 3.6 pt-20 -77.31 -21.44 53.49 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.176 177.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . 0.606 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 72.7 t60 -82.15 -40.84 21.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.485 -175.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.797 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 0.1 OUTLIER -103.24 9.84 37.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.224 -178.005 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.556 ' HG3' ' CD2' ' A' ' 129' ' ' HIS . 15.1 ttp180 -43.9 110.84 1.03 Allowed Pre-proline 0 N--CA 1.468 0.456 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.217 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 6.3 Cg_exo -78.88 107.07 2.19 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 123.279 2.652 . . . . 0.0 112.2 -178.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 16.0 m -79.29 -20.41 48.09 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.166 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.92 -57.45 8.74 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 121.016 0.436 . . . . 0.0 110.462 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 1.7 mp -116.11 81.69 1.65 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.77 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.411 ' HB ' ' O ' ' A' ' 142' ' ' PRO . 1.4 tt -110.89 144.51 18.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.299 -174.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . 0.494 ' H ' HG12 ' A' ' 131' ' ' ILE . 56.6 t-20 -69.85 -64.5 0.87 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.942 176.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -119.55 90.57 0.48 Allowed Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.895 -0.669 . . . . 0.0 111.703 178.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -113.49 95.27 0.75 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.964 -0.636 . . . . 0.0 111.998 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -106.36 2.43 26.54 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.318 0.58 . . . . 0.0 110.747 -178.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 124.53 -101.89 0.68 Allowed Glycine 0 N--CA 1.447 -0.571 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -176.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -79.71 50.4 3.84 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.793 -0.717 . . . . 0.0 111.528 176.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -93.17 156.05 17.09 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.209 0.528 . . . . 0.0 111.293 -177.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 161.07 84.37 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 -175.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.88 134.86 56.87 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.049 0.452 . . . . 0.0 112.116 -173.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 43.4 mm -66.94 136.56 26.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.623 174.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -52.98 124.95 38.92 Favored Pre-proline 0 C--N 1.331 -0.226 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 176.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . 0.446 ' O ' ' HD1' ' A' ' 407' ' ' PHE . 78.7 Cg_exo -46.31 -82.67 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.576 2.85 . . . . 0.0 113.136 -172.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . 0.629 ' CD2' ' HD2' ' A' ' 408' ' ' PRO . 0.2 OUTLIER 169.8 150.64 0.14 Allowed Pre-proline 0 C--N 1.329 -0.293 0 C-N-CA 123.437 0.695 . . . . 0.0 109.181 177.054 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . 0.667 ' HG3' HD21 ' A' ' 110' ' ' LEU . 87.0 Cg_endo -85.69 129.7 3.61 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.443 2.096 . . . . 0.0 112.606 174.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -139.53 164.04 30.95 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 177.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -74.71 110.87 9.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.679 0.276 . . . . 0.0 110.441 179.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -84.2 -90.78 0.09 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.941 -176.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -131.4 130.79 22.63 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.564 -176.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.18 131.64 35.39 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.843 2.362 . . . . 0.0 111.328 173.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.505 HG22 ' HA3' ' A' ' 85' ' ' GLY . 68.1 p -110.01 169.22 8.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.871 -172.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . 0.431 ' HB2' ' H ' ' A' ' 416' ' ' HIS . 0.8 OUTLIER 56.03 -124.35 1.95 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.867 177.166 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . 0.431 ' H ' ' HB2' ' A' ' 415' ' ' SER . 0.2 OUTLIER -117.12 126.56 27.35 Favored Pre-proline 0 C--N 1.329 -0.307 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -178.794 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 416' ' ' HIS . 14.8 Cg_exo -69.91 -31.92 18.93 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.843 2.362 . . . . 0.0 112.116 179.022 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.412 -0.804 . . . . 0.0 110.889 -179.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.524 0 N-CA-C 112.156 -0.377 . . . . 0.0 112.156 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -95.95 26.76 3.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.21 0.528 . . . . 0.0 111.07 -177.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -95.19 15.68 18.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.146 0.498 . . . . 0.0 110.265 178.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 24.5 mm -94.47 95.3 5.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.559 -176.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -111.83 16.64 20.34 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 175.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.798 HD12 ' H ' ' A' ' 84' ' ' SER . 1.2 pt? -147.82 123.11 10.26 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.911 -1.04 . . . . 0.0 108.934 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -51.83 -60.02 3.65 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 123.622 0.576 . . . . 0.0 110.433 -175.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.72 124.44 8.02 Favored Glycine 0 N--CA 1.44 -1.068 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 168.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -65.01 87.51 0.06 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 117.069 0.434 . . . . 0.0 110.119 -179.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.798 ' H ' HD12 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -148.76 -58.68 0.22 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.402 -178.727 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . 0.43 ' H ' HG23 ' A' ' 414' ' ' THR . . . -150.57 163.29 29.57 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 121.035 -0.602 . . . . 0.0 111.858 179.149 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.634 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -167.11 162.19 15.15 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 -178.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.95 143.92 26.09 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.99 14.44 6.16 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -172.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.614 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -112.01 -58.23 2.16 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 121.055 -0.258 . . . . 0.0 111.28 179.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.529 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 32.0 p -95.32 -72.85 0.61 Allowed 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.47 -175.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.529 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 130.65 6.78 3.62 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 111.751 -0.54 . . . . 0.0 111.751 -176.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -83.99 117.81 23.63 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 174.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.762 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.7 OUTLIER -62.59 124.28 20.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.703 -177.745 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.4 mt -64.85 111.33 5.57 Favored Pre-proline 0 C--N 1.329 -0.312 0 O-C-N 123.685 0.616 . . . . 0.0 112.119 -171.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.563 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 8.0 Cg_exo -73.63 168.15 25.49 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 123.064 2.509 . . . . 0.0 111.111 173.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.87 -0.49 11.41 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.868 0.366 . . . . 0.0 111.346 -178.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -116.59 13.25 15.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.009 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.563 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.6 OUTLIER -115.62 142.86 46.17 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.458 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.3 mp -109.64 138.74 45.56 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.291 -177.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -120.21 146.96 24.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.558 -178.166 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.489 ' SD ' ' HG3' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -94.98 113.01 24.67 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.864 179.434 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.51 ' H ' ' HG3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -91.25 102.68 15.39 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.721 -177.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -78.93 -35.26 43.61 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.299 0.571 . . . . 0.0 110.163 176.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -148.98 -128.72 0.05 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.323 -178.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -91.19 10.07 75.91 Favored Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 110.988 -0.845 . . . . 0.0 110.988 172.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -120.14 143.81 48.0 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.188 -0.506 . . . . 0.0 109.837 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -113.72 140.8 32.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.296 0.57 . . . . 0.0 112.411 -173.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -131.37 160.69 34.31 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 172.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.849 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 21.7 m80 -83.05 170.39 14.9 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.823 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.464 ' HA ' ' SD ' ' A' ' 101' ' ' MET . 1.7 tp -66.96 -29.35 69.19 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.289 0.566 . . . . 0.0 109.9 174.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -89.24 -11.18 44.35 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.441 177.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.849 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 34.4 m -108.34 0.17 21.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.049 -176.197 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . 0.467 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.0 OUTLIER -86.04 59.99 5.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.373 0.606 . . . . 0.0 110.3 178.064 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 1.9 p -114.22 155.5 26.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.204 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.503 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 17.1 p -68.99 153.62 43.49 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.174 0.512 . . . . 0.0 110.487 177.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.79 7.44 30.44 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.483 -176.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.48 -51.09 2.82 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -176.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -115.31 -4.52 12.38 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.508 -177.064 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.441 HH11 ' HD3' ' A' ' 119' ' ' ARG . 0.0 OUTLIER 66.13 32.04 8.4 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.105 -177.062 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . 0.426 ' HB3' ' HB3' ' A' ' 137' ' ' CYS . 58.2 t30 -79.45 124.17 28.22 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.347 177.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.432 ' HE ' ' HB3' ' A' ' 121' ' ' ARG . 1.5 ttp180 -78.87 121.82 25.32 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.725 0.298 . . . . 0.0 110.633 -178.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.556 HD13 ' HB2' ' A' ' 128' ' ' PHE . 1.9 mt -69.61 162.0 28.5 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.202 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.411 ' HA ' ' HD3' ' A' ' 124' ' ' PRO . 75.8 t -128.64 130.34 23.5 Favored Pre-proline 0 C--N 1.328 -0.331 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.685 -174.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 123' ' ' VAL . 36.3 Cg_exo -61.69 111.28 1.14 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.578 2.185 . . . . 0.0 110.81 174.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.11 -18.66 14.03 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.525 -176.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.471 ' O ' ' HA ' ' A' ' 404' ' ' ILE . 2.0 t70 -112.78 -168.91 1.38 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 177.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.45 ' HA ' ' O ' ' A' ' 208' ' ' SER . 0.0 OUTLIER -90.76 147.14 23.42 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.473 0.654 . . . . 0.0 112.246 -171.441 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.556 ' HB2' HD13 ' A' ' 122' ' ' LEU . 0.4 OUTLIER -145.33 159.77 42.54 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.711 -1.132 . . . . 0.0 108.566 175.274 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 11.2 m-70 -126.62 122.48 35.14 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.104 0.478 . . . . 0.0 111.299 -178.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.439 ' CE2' ' HA2' ' A' ' 133' ' ' GLY . 11.0 t80 -124.97 101.27 6.97 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 173.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 12.3 mt -124.54 124.18 67.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.464 -176.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 60.9 29.47 19.03 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.864 178.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.439 ' HA2' ' CE2' ' A' ' 130' ' ' TYR . . . 75.18 35.27 49.41 Favored Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.563 -179.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 15.6 m -137.0 146.29 45.15 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.9 mt -98.79 130.4 45.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.346 0.593 . . . . 0.0 111.698 -174.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.503 ' HA ' ' HB2' ' A' ' 115' ' ' CYS . 40.3 m-85 -130.77 163.44 27.31 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.543 172.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . 0.678 ' H ' ' HB2' ' A' ' 140' ' ' ASP . 31.0 p -106.54 -173.36 2.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.087 0.47 . . . . 0.0 111.366 -175.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.94 -26.43 59.6 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.492 177.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -77.96 -36.43 49.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.591 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.678 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 0.2 OUTLIER -57.66 -68.32 0.25 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.876 -1.057 . . . . 0.0 111.142 178.035 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 43.16 71.39 1.45 Allowed Pre-proline 0 N--CA 1.465 0.313 0 O-C-N 123.979 0.799 . . . . 0.0 111.389 -177.432 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -49.96 121.73 7.94 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.769 2.313 . . . . 0.0 112.244 -177.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.88 4.12 51.8 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.655 -176.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -104.2 -63.51 1.2 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.795 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -111.76 113.72 26.26 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.819 0.342 . . . . 0.0 110.236 178.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.99 157.49 28.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.065 179.625 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -78.52 -18.36 54.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.367 0.604 . . . . 0.0 110.217 177.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 168.98 100.83 0.14 Allowed Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.532 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . 0.413 ' HA2' ' OG ' ' A' ' 206' ' ' SER . . . -87.84 53.99 4.3 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.065 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.48 56.9 3.1 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.031 0.443 . . . . 0.0 110.847 -179.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 75.11 -78.95 1.05 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.304 -178.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -84.2 64.53 4.25 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.231 -0.509 . . . . 0.0 111.97 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . 0.413 ' OG ' ' HA2' ' A' ' 202' ' ' GLY . 0.4 OUTLIER -84.93 105.77 15.94 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.953 0.406 . . . . 0.0 111.044 -178.292 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 166.8 118.62 0.44 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.08 178.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . 0.45 ' O ' ' HA ' ' A' ' 127' ' ' ARG . 0.1 OUTLIER -78.7 165.21 23.88 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 177.422 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . 0.471 ' HA ' ' O ' ' A' ' 126' ' ' ASP . 51.3 mm -87.31 130.84 36.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . 0.446 ' HB2' ' HB3' ' A' ' 128' ' ' PHE . . . -60.56 123.81 75.79 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.92 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . 0.467 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 31.6 Cg_exo -60.22 154.72 50.22 Favored 'Trans proline' 0 C--O 1.233 0.254 0 C-N-CA 122.967 2.445 . . . . 0.0 112.465 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . 0.454 ' HA ' ' HD3' ' A' ' 408' ' ' PRO . 21.5 m-85 -87.25 148.24 44.32 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.989 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . 0.489 ' HG3' ' SD ' ' A' ' 101' ' ' MET . 9.9 Cg_exo -70.71 138.51 34.94 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.995 2.463 . . . . 0.0 112.089 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -143.14 177.55 8.31 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 177.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -93.53 110.74 22.31 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.861 0.363 . . . . 0.0 110.379 179.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -80.5 -91.9 0.05 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.741 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 14.1 tp -131.08 120.25 18.19 Favored Pre-proline 0 C--N 1.325 -0.458 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 178.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -62.12 121.28 9.25 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.221 1.948 . . . . 0.0 111.259 175.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.762 HG21 ' HB3' ' A' ' 93' ' ' SER . 6.5 m -75.62 153.74 37.09 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.459 -175.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 2.1 m 73.59 82.87 0.12 Allowed 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.478 0.711 . . . . 0.0 110.957 177.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . 0.643 ' HD2' ' HD2' ' A' ' 417' ' ' PRO . 0.1 OUTLIER -61.03 137.49 94.04 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.798 179.635 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . 0.643 ' HD2' ' HD2' ' A' ' 416' ' ' HIS . 95.5 Cg_endo -80.76 10.36 3.37 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.863 2.375 . . . . 0.0 112.635 177.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . 0.538 ' HA ' ' HD2' ' A' ' 418' ' ' LYS . 1.2 mmmt . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.197 -0.906 . . . . 0.0 109.795 178.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.718 0 N-CA-C 111.808 -0.517 . . . . 0.0 111.808 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -68.38 99.02 0.89 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.238 0.542 . . . . 0.0 111.249 178.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -144.89 158.07 43.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.556 177.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -69.8 110.96 3.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.096 0.474 . . . . 0.0 110.765 -179.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.574 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.3 OUTLIER -102.12 15.76 28.12 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.827 -177.868 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.785 HD13 ' HA ' ' A' ' 83' ' ' ASN . 0.1 OUTLIER -145.75 14.41 1.37 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.922 -178.668 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 49.65 -108.61 0.32 Allowed 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.973 -171.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -73.21 106.58 2.01 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 172.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.785 ' HA ' HD13 ' A' ' 80' ' ' LEU . 0.8 OUTLIER -47.02 113.96 0.76 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 122.795 0.438 . . . . 0.0 111.778 -176.248 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -163.11 -73.73 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.566 176.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -136.41 127.22 4.07 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.641 -0.79 . . . . 0.0 113.031 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.679 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -149.06 165.25 32.25 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 177.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.33 139.51 39.21 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -20.01 51.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.002 -171.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.801 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -77.79 -43.61 30.1 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.981 -0.288 . . . . 0.0 111.461 -174.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.422 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 26.9 p -103.21 -64.65 1.06 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.137 0.494 . . . . 0.0 110.36 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.574 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 118.11 45.81 0.48 Allowed Glycine 0 N--CA 1.443 -0.892 0 C-N-CA 120.932 -0.651 . . . . 0.0 111.733 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.422 ' NE2' ' H ' ' A' ' 93' ' ' SER . 0.0 OUTLIER -123.42 145.21 48.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.864 0.364 . . . . 0.0 110.261 179.231 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.758 ' HB3' HG21 ' A' ' 414' ' ' THR . 0.0 OUTLIER -67.86 143.03 55.92 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.641 176.766 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.6 mt -111.86 101.84 52.31 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.716 -178.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.38 168.45 22.87 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 123.234 2.623 . . . . 0.0 111.519 173.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.49 4.37 4.92 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -175.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -96.67 -17.94 20.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.297 0.57 . . . . 0.0 110.07 177.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -102.86 153.31 20.31 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.327 -174.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.552 HD23 ' HB2' ' A' ' 408' ' ' PRO . 1.0 OUTLIER -109.67 143.87 38.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.974 0.416 . . . . 0.0 110.921 -176.672 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 162.19 36.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.785 -179.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.49 113.66 23.12 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.972 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -104.68 117.16 33.4 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.647 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -79.27 -59.76 2.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.768 176.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.28 114.25 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.389 176.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.43 -70.14 3.01 Favored Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.257 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -89.85 152.73 21.12 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.822 0.344 . . . . 0.0 110.492 -179.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.6 p -119.88 145.5 26.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.345 -177.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -137.99 -175.56 4.14 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.781 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.886 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 26.3 m80 -106.38 -179.72 4.02 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.383 -0.228 . . . . 0.0 110.383 179.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.37 -41.96 88.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.132 0.491 . . . . 0.0 110.187 178.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.676 ' HE2' ' SG ' ' A' ' 112' ' ' CYS . 0.1 OUTLIER -80.02 -28.35 39.36 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.367 179.134 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.886 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 27.6 m -79.64 -16.32 56.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.182 -178.484 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . 0.579 ' HE2' ' HD2' ' A' ' 406' ' ' PRO . 0.0 OUTLIER -76.67 82.15 3.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.251 178.257 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.553 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.0 OUTLIER -136.35 158.24 44.9 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.131 -178.263 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.544 ' HB2' ' HA ' ' A' ' 136' ' ' PHE . 3.4 p -72.26 152.19 42.33 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 176.097 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 2.4 m -87.27 5.44 38.3 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -175.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -114.61 -50.63 2.78 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -176.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.753 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -115.11 6.99 15.29 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.809 0.338 . . . . 0.0 110.495 -177.959 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER 52.13 40.18 28.16 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.266 -179.074 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . 0.759 HD22 ' HB2' ' A' ' 137' ' ' CYS . 40.1 t30 -81.33 130.13 34.91 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.558 178.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.553 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.6 OUTLIER -76.5 123.21 25.69 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.945 -175.918 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.516 HD13 ' HD2' ' A' ' 128' ' ' PHE . 4.6 mt -80.19 138.21 36.82 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.063 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -134.43 139.89 34.11 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.455 -174.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.455 ' HB3' ' CE2' ' A' ' 407' ' ' PHE . 52.8 Cg_exo -54.26 118.95 5.58 Favored 'Trans proline' 0 N--CA 1.463 -0.305 0 C-N-CA 122.575 2.183 . . . . 0.0 111.425 173.417 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 100.27 -0.27 55.89 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.53 -176.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -119.58 -173.35 2.51 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.727 0.299 . . . . 0.0 110.328 177.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -91.88 126.46 36.98 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.984 0.421 . . . . 0.0 111.166 -172.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.516 ' HD2' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -137.08 135.36 37.41 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 174.802 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -124.07 115.98 22.05 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.142 0.496 . . . . 0.0 111.13 -177.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.465 ' HB2' ' CZ ' ' A' ' 128' ' ' PHE . 6.2 t80 -103.47 101.41 11.3 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 178.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 4.6 mt -118.92 115.28 47.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.622 -176.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 3.3 m120 58.9 31.76 21.61 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.375 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.41 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 80.61 34.36 28.47 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.442 -0.885 . . . . 0.0 112.687 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.493 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 0.4 OUTLIER -139.69 140.17 36.78 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 -179.55 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.3 mt -91.1 122.23 33.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.073 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.544 ' HA ' ' HB2' ' A' ' 115' ' ' CYS . 70.6 m-85 -128.74 158.88 37.37 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.622 176.25 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . 0.759 ' HB2' HD22 ' A' ' 120' ' ' ASN . 8.5 p -114.08 -168.97 1.43 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.017 0.437 . . . . 0.0 111.35 -177.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.25 -22.47 48.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.053 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . 0.711 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 37.2 m-70 -78.16 -28.93 48.4 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 120.997 0.427 . . . . 0.0 110.574 -176.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.753 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 0.8 OUTLIER -123.02 29.04 6.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.471 -178.6 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.432 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 45.0 ttt180 -51.55 111.19 2.21 Favored Pre-proline 0 N--CA 1.469 0.521 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.706 -178.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 1.0 OUTLIER -84.81 83.08 1.63 Allowed 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 123.366 2.71 . . . . 0.0 112.17 -178.78 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.8 -1.02 4.71 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -178.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -67.46 -17.34 64.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.799 0.333 . . . . 0.0 111.385 179.212 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.468 ' HB3' ' H ' ' A' ' 146' ' ' ILE . 3.9 tp -143.21 -102.37 0.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.685 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.468 ' H ' ' HB3' ' A' ' 145' ' ' LEU . 56.4 mt 62.73 101.56 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-O 121.059 0.457 . . . . 0.0 111.292 -175.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -68.36 98.73 0.86 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.205 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 99.17 23.25 11.56 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.849 -0.691 . . . . 0.0 111.81 -177.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -79.37 64.16 3.83 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 121.346 -0.454 . . . . 0.0 112.117 177.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.28 87.43 1.48 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.791 0.329 . . . . 0.0 110.849 178.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 69.33 -105.04 1.4 Allowed Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.165 179.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -93.67 -5.12 63.29 Favored Glycine 0 N--CA 1.445 -0.73 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.245 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 14.5 m -62.46 136.39 57.88 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.4 0.619 . . . . 0.0 111.86 -176.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -154.01 -163.16 11.64 Favored Glycine 0 N--CA 1.446 -0.687 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.974 178.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . 0.477 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 43.9 m -114.83 160.16 19.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.36 0.6 . . . . 0.0 111.311 -179.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 5.4 mm -111.57 138.16 41.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.357 178.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . 0.439 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -58.8 123.87 70.35 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-O 120.909 0.385 . . . . 0.0 111.532 -178.063 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . 0.579 ' HD2' ' HE2' ' A' ' 113' ' ' PHE . 31.4 Cg_exo -59.81 161.61 17.98 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.293 2.662 . . . . 0.0 112.491 177.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . 0.455 ' CE2' ' HB3' ' A' ' 124' ' ' PRO . 34.1 m-85 -94.77 156.46 38.19 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.481 -177.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . 0.552 ' HB2' HD23 ' A' ' 99' ' ' LEU . 50.5 Cg_endo -69.3 140.46 44.45 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.895 2.397 . . . . 0.0 112.752 179.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -144.82 175.78 9.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.516 178.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -98.08 109.74 22.44 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 174.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -85.77 -89.35 0.11 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.447 -175.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.482 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 2.1 tp -131.21 128.88 22.26 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.157 -178.021 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 3.2 Cg_exo -75.6 155.41 40.19 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.911 2.407 . . . . 0.0 111.913 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.758 HG21 ' HB3' ' A' ' 93' ' ' SER . 0.2 OUTLIER -83.06 176.5 9.18 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.772 177.055 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . 0.45 ' O ' ' HD3' ' A' ' 417' ' ' PRO . 0.2 OUTLIER -53.5 137.74 35.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.179 177.515 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 14.7 m170 -86.35 110.68 33.37 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.596 -178.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . 0.45 ' HD3' ' O ' ' A' ' 415' ' ' SER . 68.0 Cg_endo -90.85 -32.21 0.1 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.73 2.286 . . . . 0.0 113.211 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.246 0.899 0 CA-C-O 118.376 -0.821 . . . . 0.0 111.178 -175.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.619 0 N-CA-C 112.01 -0.436 . . . . 0.0 112.01 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.49 166.13 29.09 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.839 0.352 . . . . 0.0 110.465 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -134.34 107.45 7.63 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.718 0.294 . . . . 0.0 110.595 178.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 37.5 mt -118.82 126.92 75.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.341 -179.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.451 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.1 OUTLIER -126.49 -32.79 2.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.249 0.547 . . . . 0.0 110.329 177.537 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.754 HD11 ' H ' ' A' ' 84' ' ' SER . 1.5 pt? -98.86 155.31 17.45 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.597 179.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -73.22 -78.96 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.849 0.356 . . . . 0.0 111.077 -176.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -77.27 96.58 1.24 Allowed Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.473 -0.87 . . . . 0.0 111.17 175.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.473 ' HA ' HD11 ' A' ' 80' ' ' LEU . 58.4 t30 -56.41 100.69 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.229 0.537 . . . . 0.0 111.865 -174.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.754 ' H ' HD11 ' A' ' 80' ' ' LEU . 4.4 m -153.99 -62.15 0.13 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.708 175.53 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -141.73 118.56 1.34 Allowed Glycine 0 C--N 1.333 0.399 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.735 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.481 ' HB2' HD13 ' A' ' 80' ' ' LEU . . . -135.78 149.25 49.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.761 0.315 . . . . 0.0 110.424 179.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.888 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 3.3 t -57.18 145.93 29.77 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.262 177.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.5 m -99.63 -1.38 38.19 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.861 172.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.699 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -102.22 -59.26 1.73 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.014 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 30.7 p -93.98 -31.6 14.19 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 120.265 -0.574 . . . . 0.0 109.862 176.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.888 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 92.83 14.45 55.05 Favored Glycine 0 N--CA 1.45 -0.394 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.953 172.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -89.69 146.84 24.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.722 0.261 . . . . 0.0 110.759 178.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.464 ' HB2' HG21 ' A' ' 414' ' ' THR . 0.0 OUTLIER -66.08 140.31 58.24 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.457 176.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.7 mt -110.78 119.34 46.44 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -174.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -78.37 155.53 28.66 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.938 2.425 . . . . 0.0 110.628 167.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.797 ' HB2' ' HG3' ' A' ' 413' ' ' PRO . . . -68.07 -15.23 63.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.972 0.415 . . . . 0.0 111.116 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.94 -5.37 53.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.633 178.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -111.43 120.22 41.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.638 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.5 tp -76.1 128.53 35.18 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.968 0.413 . . . . 0.0 110.786 -178.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -116.59 140.02 40.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.335 -179.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.94 112.6 20.3 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.449 ' HD3' ' OE2' ' A' ' 409' ' ' GLU . 0.0 OUTLIER -88.42 150.46 23.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.175 -176.118 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -130.58 -134.78 0.21 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.331 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.73 69.75 3.14 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.093 0.473 . . . . 0.0 110.561 -179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 85.42 -25.79 6.14 Favored Glycine 0 N--CA 1.452 -0.275 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.435 179.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -89.35 156.14 18.9 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.734 0.302 . . . . 0.0 111.044 -177.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.29 132.59 67.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.791 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . 0.483 ' HD1' ' HB2' ' A' ' 89' ' ' ALA . 44.8 m-85 -128.15 171.28 12.07 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.332 176.412 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.959 ' H ' ' HB2' ' A' ' 112' ' ' CYS . 23.8 m80 -101.36 179.22 4.42 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 177.159 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.7 mt -62.34 -28.61 69.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.227 0.537 . . . . 0.0 110.698 177.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.512 ' HG3' ' H ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.06 -34.37 15.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.289 176.919 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.959 ' HB2' ' H ' ' A' ' 109' ' ' HIS . 4.2 m -78.78 -5.7 54.02 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.836 -175.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -96.38 66.0 2.37 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 172.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.576 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.5 OUTLIER -119.97 158.03 27.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.76 -178.95 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.559 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 5.6 t -62.61 152.5 34.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.292 173.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.2 m -87.1 -32.89 19.67 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.799 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -99.12 -51.59 3.79 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -174.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.461 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 8.3 p -90.23 -20.33 23.13 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.89 0.376 . . . . 0.0 110.116 178.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.559 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 69.52 25.28 5.4 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.844 175.201 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . 0.461 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 5.1 m-80 -70.1 128.35 35.99 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 174.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.576 ' HA ' HG22 ' A' ' 114' ' ' THR . 9.7 ttp85 -65.64 116.99 7.45 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 176.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 19.9 mt -65.5 151.99 45.07 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.731 0.301 . . . . 0.0 110.345 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 90.7 t -123.47 131.31 24.3 Favored Pre-proline 0 C--N 1.325 -0.466 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.651 -171.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.455 ' HA ' ' HB3' ' A' ' 405' ' ' ALA . 27.0 Cg_endo -65.01 110.43 1.5 Allowed 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 121.814 1.676 . . . . 0.0 110.596 172.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.52 -17.05 14.15 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.415 -173.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -117.33 -161.18 0.8 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.82 150.34 27.9 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -169.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.538 ' O ' ' HB2' ' A' ' 208' ' ' SER . 0.0 OUTLIER -157.62 135.82 11.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.18 -1.373 . . . . 0.0 108.251 172.175 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -126.09 128.59 47.6 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.89 0.376 . . . . 0.0 110.574 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.405 ' HA ' ' O ' ' A' ' 134' ' ' SER . 9.8 t80 -124.81 102.56 7.62 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.836 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.782 HD13 ' HG2' ' A' ' 142' ' ' PRO . 2.6 mp -131.32 130.43 63.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 -179.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.51 32.14 20.42 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 123.463 0.477 . . . . 0.0 110.248 -179.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 64.87 36.09 92.68 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.523 -177.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.405 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.9 OUTLIER -131.62 147.85 52.56 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.464 -0.433 . . . . 0.0 109.884 -179.135 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 13.7 mt -101.26 115.06 29.63 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.322 -174.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -122.16 173.32 7.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.67 174.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . 0.772 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 29.4 p -119.09 -165.93 1.2 Allowed 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 177.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.09 -25.99 47.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.265 0.555 . . . . 0.0 109.51 175.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . 0.772 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 68.4 t60 -74.57 -24.34 58.9 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.256 -0.884 . . . . 0.0 108.738 176.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.535 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 1.7 m-20 -113.8 23.73 12.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.486 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.431 HH21 ' CB ' ' A' ' 206' ' ' SER . 24.5 ttt-85 -62.88 115.14 15.13 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.125 -175.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.782 ' HG2' HD13 ' A' ' 131' ' ' ILE . 44.9 Cg_exo -56.89 114.87 2.12 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.042 2.494 . . . . 0.0 112.645 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -18.25 56.95 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.762 -179.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -99.05 -98.88 0.22 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.251 -175.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.42 75.84 10.2 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.326 -176.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 5.4 tt -97.51 120.89 47.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 175.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . 0.513 ' H ' HG12 ' A' ' 131' ' ' ILE . 5.4 t30 -89.84 74.92 7.35 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.201 0.524 . . . . 0.0 110.394 179.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 158.74 44.15 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.711 -178.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -84.65 46.69 3.72 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.026 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.67 82.01 1.13 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.008 0.432 . . . . 0.0 110.8 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 73.28 -102.0 1.21 Allowed Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.803 -0.713 . . . . 0.0 111.568 -178.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -75.75 -15.88 81.01 Favored Glycine 0 CA--C 1.518 0.24 0 C-N-CA 121.258 -0.496 . . . . 0.0 112.626 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . 0.431 ' CB ' HH21 ' A' ' 141' ' ' ARG . 0.7 OUTLIER 59.56 67.17 0.91 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 122.705 0.402 . . . . 0.0 111.379 179.721 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -133.5 130.02 5.55 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.873 -0.679 . . . . 0.0 111.634 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . 0.538 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -120.66 138.66 53.82 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.947 0.403 . . . . 0.0 111.431 -178.849 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 35.5 mm -101.06 142.16 16.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.836 178.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . 0.455 ' HB3' ' HA ' ' A' ' 124' ' ' PRO . . . -52.9 136.52 46.48 Favored Pre-proline 0 C--O 1.233 0.218 0 CA-C-O 120.757 0.313 . . . . 0.0 111.209 177.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . 0.5 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 11.7 Cg_exo -72.17 2.17 5.24 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.521 2.814 . . . . 0.0 113.335 -174.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . 0.5 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 10.0 m-85 73.89 156.95 0.16 Allowed Pre-proline 0 N--CA 1.469 0.505 0 O-C-N 123.673 0.608 . . . . 0.0 111.395 178.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -83.71 136.02 7.1 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.882 2.388 . . . . 0.0 112.05 177.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . 0.449 ' OE2' ' HD3' ' A' ' 102' ' ' ARG . 1.0 OUTLIER -137.87 177.82 7.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.162 179.358 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -97.31 126.55 42.6 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.786 0.327 . . . . 0.0 110.626 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -94.84 -168.25 1.78 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.377 178.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.443 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.4 OUTLIER -71.86 128.62 89.22 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.394 179.708 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . 0.797 ' HG3' ' HB2' ' A' ' 96' ' ' ALA . 10.0 Cg_exo -72.2 130.42 16.4 Favored 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 122.959 2.439 . . . . 0.0 112.626 -175.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.475 ' HA ' ' HB2' ' A' ' 84' ' ' SER . 0.4 OUTLIER -79.29 161.18 26.45 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.1 178.122 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.88 157.1 22.36 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 44.5 m170 -92.04 152.87 43.17 Favored Pre-proline 0 C--O 1.233 0.221 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.073 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -78.89 178.35 7.64 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.647 2.232 . . . . 0.0 112.154 176.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 1.3 mmtm . . . . . 0 C--O 1.245 0.848 0 CA-C-O 118.455 -0.783 . . . . 0.0 110.601 -178.652 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.591 0 N-CA-C 111.77 -0.532 . . . . 0.0 111.77 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.36 -45.3 2.93 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.814 0.34 . . . . 0.0 110.332 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 1.9 t80 57.93 43.91 20.61 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.092 179.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -112.19 127.88 69.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.907 0.384 . . . . 0.0 110.789 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -145.47 22.38 1.49 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.36 178.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.677 ' HB2' ' HA ' ' A' ' 83' ' ' ASN . 0.8 OUTLIER -140.46 131.14 25.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.757 -177.867 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -81.1 104.41 11.57 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 176.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.43 5.43 86.99 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.468 -0.873 . . . . 0.0 111.892 -177.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.677 ' HA ' ' HB2' ' A' ' 80' ' ' LEU . 23.5 t-20 59.7 55.6 3.92 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.133 0.492 . . . . 0.0 111.434 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.41 ' HB2' ' N ' ' A' ' 415' ' ' SER . 29.1 m -157.96 107.4 2.09 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.415 175.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.36 133.29 1.79 Allowed Glycine 0 CA--C 1.519 0.328 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.824 178.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.43 ' HA ' ' HA ' ' A' ' 93' ' ' SER . . . -167.4 150.71 6.28 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 177.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.93 145.96 30.61 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.15 -10.76 59.06 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.08 -170.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.812 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -85.14 -46.91 10.66 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.164 -176.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.553 ' SG ' ' N ' ' A' ' 91' ' ' GLY . 30.5 p -102.95 -77.35 0.56 Allowed 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.873 -178.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.553 ' N ' ' SG ' ' A' ' 90' ' ' CYS . . . 147.33 -1.12 0.72 Allowed Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.742 -177.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -83.21 146.02 28.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.895 0.379 . . . . 0.0 110.181 177.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.43 ' HA ' ' HA ' ' A' ' 86' ' ' ALA . 1.2 m -76.48 169.09 18.91 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.159 176.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.7 mt -111.25 104.74 56.52 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-O 120.744 0.307 . . . . 0.0 111.244 -176.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.912 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 2.9 Cg_exo -76.29 167.75 25.22 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.853 2.369 . . . . 0.0 111.012 173.039 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.24 -9.01 51.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.06 0.457 . . . . 0.0 111.195 -178.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.31 -10.77 34.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.876 178.332 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.912 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 3.3 mm-40 -101.81 163.13 12.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.506 -179.333 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.559 ' HB2' HD12 ' A' ' 110' ' ' LEU . 10.3 mt -132.66 133.75 43.97 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.524 -178.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.406 HG12 ' HA ' ' A' ' 109' ' ' HIS . 2.0 m -118.21 148.97 20.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.828 179.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.64 121.97 37.91 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 175.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.406 ' HA ' HG12 ' A' ' 107' ' ' VAL . 14.4 ttt85 -88.52 129.21 35.52 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.47 -175.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -112.22 -147.93 0.42 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.59 77.79 2.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.934 0.397 . . . . 0.0 110.736 178.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 92.5 -42.39 2.7 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.857 -0.611 . . . . 0.0 112.603 176.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -89.7 156.24 18.68 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.838 0.351 . . . . 0.0 110.797 -178.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.406 HG12 ' HA ' ' A' ' 102' ' ' ARG . 0.4 OUTLIER -127.95 148.87 32.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.592 179.688 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -136.63 149.92 48.25 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 178.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.896 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 33.9 m80 -71.35 171.35 11.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.902 0.382 . . . . 0.0 110.798 -177.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.559 HD12 ' HB2' ' A' ' 99' ' ' LEU . 0.3 OUTLIER -61.26 -26.19 67.59 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.101 0.477 . . . . 0.0 111.171 175.971 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.417 ' HG2' ' H ' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.82 -20.64 22.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.881 177.478 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.896 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 7.5 m -100.31 -18.65 16.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.184 -170.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -67.6 83.57 0.18 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.086 0.47 . . . . 0.0 110.201 176.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.574 HG22 ' HA ' ' A' ' 121' ' ' ARG . 2.5 p -135.67 160.63 37.91 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.528 -174.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.532 ' HB3' ' H ' ' A' ' 120' ' ' ASN . 37.2 t -60.88 154.18 22.86 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.626 177.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 1.2 m -95.64 -10.39 29.53 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.092 178.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -107.94 -52.48 2.76 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.839 -0.345 . . . . 0.0 111.815 -179.444 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.414 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -98.97 -20.09 16.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.11 0.481 . . . . 0.0 109.96 179.124 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.517 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.1 OUTLIER 64.94 37.54 6.91 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.891 -178.288 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . 0.55 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 72.8 m-20 -75.53 140.95 43.05 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 174.394 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.574 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.1 OUTLIER -77.6 112.41 14.37 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 176.492 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.547 HD13 ' HB2' ' A' ' 128' ' ' PHE . 10.0 mt -70.7 152.46 43.81 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.362 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 8.9 t -119.09 135.04 23.65 Favored Pre-proline 0 C--N 1.325 -0.468 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.955 -168.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -56.99 111.59 0.85 Allowed 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 122.581 2.187 . . . . 0.0 111.207 174.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.59 5.9 56.6 Favored Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.513 -178.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -126.05 -173.95 2.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.757 0.313 . . . . 0.0 111.043 177.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.457 ' HA ' ' O ' ' A' ' 208' ' ' SER . 6.9 mmt-85 -73.86 136.64 43.46 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.383 0.611 . . . . 0.0 112.294 -171.131 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.547 ' HB2' HD13 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -148.84 153.28 37.86 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.966 -1.015 . . . . 0.0 108.578 175.517 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -135.45 133.62 38.76 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.492 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.406 ' HA ' ' O ' ' A' ' 134' ' ' SER . 5.1 t80 -126.17 102.11 7.06 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.378 175.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.47 HD12 ' HD2' ' A' ' 136' ' ' PHE . 2.8 mp -127.68 128.04 69.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 -178.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.5 m120 61.02 32.56 19.86 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.579 0.549 . . . . 0.0 111.016 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 68.07 35.27 83.4 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.436 -0.888 . . . . 0.0 112.037 -178.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.406 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.7 OUTLIER -138.41 146.91 42.77 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -178.253 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 9.6 mt -99.34 129.12 45.52 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.899 0.38 . . . . 0.0 110.617 -176.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.47 ' HD2' HD12 ' A' ' 131' ' ' ILE . 69.2 m-85 -129.44 161.24 30.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.501 179.4 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . 0.55 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 6.1 m -93.31 176.1 6.52 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.059 0.456 . . . . 0.0 109.831 175.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.95 -14.22 59.61 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 162.247 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . 0.46 ' HB3' ' HB2' ' A' ' 137' ' ' CYS . 67.8 t60 -70.11 -46.83 63.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.129 -1.396 . . . . 0.0 110.517 177.221 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.414 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 1.9 p-10 -109.83 13.52 23.54 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.281 -177.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.521 ' HE ' ' HB2' ' A' ' 206' ' ' SER . 22.2 ttt-85 -47.55 114.4 3.1 Favored Pre-proline 0 N--CA 1.468 0.445 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.998 -177.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 6.0 Cg_exo -79.85 118.92 3.86 Favored 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 123.286 2.657 . . . . 0.0 112.262 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -11.21 60.66 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -99.24 -18.61 17.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.949 0.404 . . . . 0.0 111.355 -179.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 1.2 mt -127.79 83.4 2.16 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.009 0.433 . . . . 0.0 110.31 -178.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -139.5 139.94 37.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.035 -179.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -100.39 78.0 1.99 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.081 0.467 . . . . 0.0 110.18 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 100.16 173.16 30.05 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.107 -178.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . 0.451 ' HA3' ' OG ' ' A' ' 206' ' ' SER . . . 123.18 148.22 7.54 Favored Glycine 0 N--CA 1.442 -0.909 0 C-N-CA 120.782 -0.723 . . . . 0.0 111.898 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 2.6 m -112.68 35.96 3.64 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.22 0.533 . . . . 0.0 110.797 -178.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 123.71 -62.01 0.57 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.775 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -75.97 -44.69 18.29 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.254 178.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . 0.521 ' HB2' ' HE ' ' A' ' 141' ' ' ARG . 7.8 m 50.82 65.02 1.59 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 122.462 0.305 . . . . 0.0 111.172 -178.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -110.34 85.49 0.4 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.588 -178.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . 0.457 ' O ' ' HA ' ' A' ' 127' ' ' ARG . 0.0 OUTLIER -73.09 148.58 43.86 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.862 0.363 . . . . 0.0 110.599 178.731 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 48.3 mm -104.42 136.89 35.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.348 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -60.82 126.11 84.67 Favored Pre-proline 0 C--N 1.33 -0.261 0 O-C-N 123.42 0.45 . . . . 0.0 109.955 176.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . 0.552 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 82.9 Cg_exo -44.05 -71.06 0.06 OUTLIER 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.722 2.948 . . . . 0.0 113.133 -173.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . 0.552 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 0.2 OUTLIER 149.92 157.93 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.691 0 C-N-CA 125.185 1.394 . . . . 0.0 108.739 177.558 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . 0.532 ' HD2' ' CD2' ' A' ' 407' ' ' PHE . 39.7 Cg_exo -61.42 132.29 40.23 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.692 2.261 . . . . 0.0 112.05 174.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -138.4 154.38 48.91 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.956 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -86.73 130.84 34.32 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 176.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -107.38 -120.3 0.25 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.258 -177.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.426 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 0.2 OUTLIER -96.38 129.13 34.23 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.156 -179.217 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 20.7 Cg_exo -66.17 151.23 84.13 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 123.213 2.609 . . . . 0.0 112.771 -177.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 26.5 m -68.32 141.96 55.65 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.815 177.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . 0.41 ' N ' ' HB2' ' A' ' 84' ' ' SER . 12.6 p 62.59 179.08 0.14 Allowed 'General case' 0 N--CA 1.467 0.376 0 O-C-N 124.094 0.871 . . . . 0.0 111.704 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -112.13 91.63 16.4 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 172.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -81.47 8.95 4.1 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.036 2.491 . . . . 0.0 112.429 -176.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.635 -0.698 . . . . 0.0 110.498 -178.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.746 0 N-CA-C 111.997 -0.441 . . . . 0.0 111.997 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.59 66.69 2.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.976 0.417 . . . . 0.0 111.462 -178.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -118.22 149.37 41.21 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 177.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -98.88 127.53 51.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.993 0.901 . . . . 0.0 112.558 -169.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.7 ttp180 -138.7 12.38 2.71 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.535 -1.211 . . . . 0.0 108.018 169.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.639 ' HB3' ' HA ' ' A' ' 83' ' ' ASN . 2.6 mm? -105.77 117.53 34.26 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 114.582 -1.19 . . . . 0.0 110.681 -173.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -70.36 -48.5 56.04 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.706 178.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -102.87 -12.8 31.19 Favored Glycine 0 N--CA 1.454 -0.155 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.203 178.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.639 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 1.4 t30 67.77 37.36 3.23 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.083 0.468 . . . . 0.0 111.243 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -116.16 -69.84 0.83 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.801 179.233 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . 0.459 ' O ' ' HA ' ' A' ' 93' ' ' SER . . . -133.64 143.42 15.1 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.983 -0.627 . . . . 0.0 111.999 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -147.88 170.77 16.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.708 0.254 . . . . 0.0 110.679 -177.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.665 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 50.4 t -75.01 145.77 42.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.567 179.144 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.7 m -80.93 -9.6 59.81 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.372 176.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -113.75 -58.01 2.21 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.802 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 37.7 m -71.19 -43.04 68.2 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.481 0.658 . . . . 0.0 109.972 178.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.665 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 87.2 0.28 85.21 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.586 -176.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.03 132.37 38.91 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.459 ' HA ' ' O ' ' A' ' 85' ' ' GLY . 0.0 OUTLIER -57.89 123.38 15.6 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 175.917 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.453 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 8.0 mt -79.24 117.13 65.27 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.26 -176.294 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.538 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 2.7 Cg_exo -77.66 158.89 31.97 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 123.098 2.532 . . . . 0.0 111.271 174.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.713 ' HB2' ' HB3' ' A' ' 413' ' ' PRO . . . -66.37 -21.76 66.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.226 0.536 . . . . 0.0 111.001 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.96 2.39 30.95 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.509 -179.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.538 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -107.88 159.32 16.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.075 0.464 . . . . 0.0 110.904 -178.732 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.2 mt -121.42 124.66 45.04 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.574 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.551 ' HB ' ' O ' ' A' ' 108' ' ' TYR . 19.2 m -123.44 169.51 14.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.135 -173.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -115.77 112.26 21.75 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.22 0.533 . . . . 0.0 109.943 178.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.71 98.06 10.18 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.261 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -74.64 -45.37 45.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.504 178.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.434 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -161.53 -129.18 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -179.988 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.434 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -66.24 -22.37 70.88 Favored Glycine 0 N--CA 1.451 -0.326 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 173.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -89.15 135.37 33.6 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 177.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 2.5 p -123.12 128.24 74.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.442 -177.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . 0.551 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 38.7 m-85 -125.49 176.61 6.71 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.147 -179.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.79 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 70.4 m80 -99.42 -149.58 0.36 Allowed 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 175.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.425 ' H ' ' HG ' ' A' ' 110' ' ' LEU . 0.0 OUTLIER -86.87 -30.12 21.66 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.146 174.4 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.432 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -89.8 -34.02 16.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.797 0.332 . . . . 0.0 111.863 -172.239 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.79 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.1 OUTLIER -75.74 -19.4 59.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.261 0.553 . . . . 0.0 110.498 -176.402 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -76.41 72.31 3.13 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.412 176.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.635 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.1 p -137.79 157.95 45.37 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.453 -178.286 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.452 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 11.4 p -79.02 154.25 29.62 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 120.867 0.365 . . . . 0.0 110.247 176.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -53.78 18.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -174.128 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.6 -50.8 14.43 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -168.164 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -99.31 -13.58 19.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.595 0.236 . . . . 0.0 111.422 -175.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.452 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.9 OUTLIER 63.33 42.98 6.44 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.658 -179.389 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -77.99 122.7 25.88 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.408 176.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.635 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.0 OUTLIER -73.25 122.68 22.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.733 0.301 . . . . 0.0 110.683 179.802 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.491 HD22 ' HB2' ' A' ' 128' ' ' PHE . 8.9 mt -71.83 143.08 49.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 176.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.3 t -139.17 138.36 20.73 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-O 121.031 0.443 . . . . 0.0 111.568 -166.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.3 110.98 1.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.576 2.184 . . . . 0.0 110.865 175.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 120.77 -15.86 9.61 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 -175.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -113.72 -159.44 0.69 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 175.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 127' ' ' ARG . 0.0 OUTLIER -118.99 129.36 55.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.158 0.504 . . . . 0.0 111.444 -175.754 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.491 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.6 OUTLIER -117.53 138.64 51.76 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 172.538 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -104.88 108.98 20.76 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.93 0.395 . . . . 0.0 111.068 -177.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -95.77 100.86 12.52 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 174.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.435 ' HA ' ' OD1' ' A' ' 147' ' ' ASN . 57.1 mt -122.95 122.88 66.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.089 -175.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.4 t30 58.85 28.77 17.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.599 -176.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 73.38 32.66 59.68 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.34 -178.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 3.9 m -132.57 155.92 47.8 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 -177.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 67.3 mt -95.72 116.62 29.14 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 123.242 0.339 . . . . 0.0 110.821 -176.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -125.79 150.83 47.47 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.916 177.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . 0.563 ' SG ' ' HB2' ' A' ' 139' ' ' HIS . 17.8 p -99.47 -172.39 2.25 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.357 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -77.56 -20.83 53.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.873 0.368 . . . . 0.0 110.744 177.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . 0.563 ' HB2' ' SG ' ' A' ' 137' ' ' CYS . 1.0 OUTLIER -81.81 -38.82 24.95 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 178.252 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.484 ' HB2' ' H ' ' A' ' 137' ' ' CYS . 2.0 m-20 -74.74 -31.24 61.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.402 -1.272 . . . . 0.0 110.586 178.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -20.79 101.88 0.07 OUTLIER Pre-proline 0 N--CA 1.47 0.538 0 O-C-N 125.294 1.621 . . . . 0.0 114.103 -177.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -70.74 162.61 41.98 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 122.901 2.401 . . . . 0.0 112.322 176.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 98.4 m -110.12 150.4 28.65 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.24 -0.436 . . . . 0.0 109.89 176.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . 73.94 -62.04 0.48 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.399 0.679 . . . . 0.0 111.607 178.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.62 62.29 7.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.094 0.473 . . . . 0.0 110.206 179.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.516 ' H ' HG13 ' A' ' 146' ' ' ILE . 0.0 OUTLIER -117.54 78.37 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.311 178.173 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . 0.435 ' OD1' ' HA ' ' A' ' 131' ' ' ILE . 0.8 OUTLIER -70.09 -17.42 63.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.608 -176.986 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -114.61 24.25 11.32 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.927 178.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -134.75 123.99 3.32 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.085 -178.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.83 82.38 7.52 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 174.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 78.39 -59.02 4.06 Favored Glycine 0 N--CA 1.45 -0.41 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 -176.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -134.99 -114.82 1.45 Allowed Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 111.126 -0.79 . . . . 0.0 111.126 175.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -82.5 99.4 9.46 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.045 0.45 . . . . 0.0 111.067 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -126.48 28.09 4.83 Favored Glycine 0 N--CA 1.446 -0.645 0 C-N-CA 120.915 -0.659 . . . . 0.0 111.868 179.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.09 162.74 34.21 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 -177.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . 0.426 ' O ' ' HD1' ' A' ' 128' ' ' PHE . 15.4 mm -125.05 -94.03 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 O-C-N 123.292 0.37 . . . . 0.0 110.067 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . 0.439 ' HA ' ' CD1' ' A' ' 128' ' ' PHE . . . -169.9 157.34 6.25 Favored Pre-proline 0 C--O 1.234 0.244 0 N-CA-C 110.41 -0.219 . . . . 0.0 110.41 -177.224 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . 0.496 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 73.6 Cg_endo -77.76 -19.3 12.78 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.293 1.995 . . . . 0.0 111.318 174.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . 0.496 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 4.4 m-85 76.17 149.93 0.13 Allowed Pre-proline 0 CA--C 1.533 0.312 0 O-C-N 124.419 1.074 . . . . 0.0 111.381 177.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.38 116.54 4.35 Favored 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.564 2.176 . . . . 0.0 112.646 178.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -136.8 177.31 7.96 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.927 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -89.58 134.33 34.18 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.144 -179.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -107.21 -166.38 1.15 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.429 178.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 413' ' ' PRO . 2.4 mp -67.64 122.49 83.65 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.321 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . 0.713 ' HB3' ' HB2' ' A' ' 96' ' ' ALA . 7.0 Cg_exo -72.92 135.85 24.05 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 123.088 2.525 . . . . 0.0 113.04 -175.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -67.08 153.39 43.78 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.601 176.06 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.1 m -64.72 167.72 7.03 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 417' ' ' PRO . 94.1 m-70 -69.18 139.9 90.33 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.878 -179.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 416' ' ' HIS . 62.0 Cg_endo -91.69 -165.2 0.15 Allowed 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 123.429 2.753 . . . . 0.0 112.853 -178.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.773 -0.632 . . . . 0.0 110.024 177.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.828 0 N-CA-C 111.849 -0.501 . . . . 0.0 111.849 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.14 88.95 2.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.018 0.437 . . . . 0.0 111.047 -179.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -118.07 -1.28 11.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.148 0.499 . . . . 0.0 110.86 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -81.31 65.01 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.407 0.623 . . . . 0.0 111.53 -175.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.26 -9.24 22.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.085 177.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.631 ' HG ' ' HB2' ' A' ' 86' ' ' ALA . 5.1 mp -99.53 14.42 29.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.72 -173.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.561 ' HB2' ' OG ' ' A' ' 93' ' ' SER . 0.2 OUTLIER 47.58 56.25 7.31 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 123.624 0.578 . . . . 0.0 112.184 176.322 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.33 5.2 59.34 Favored Glycine 0 C--N 1.327 0.046 0 C-N-CA 120.429 -0.891 . . . . 0.0 111.981 -178.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.467 ' HA ' ' CB ' ' A' ' 80' ' ' LEU . 61.3 t30 69.24 65.49 0.27 Allowed 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 123.68 0.792 . . . . 0.0 112.285 175.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.526 ' CB ' ' HA ' ' A' ' 414' ' ' THR . 0.1 OUTLIER -106.36 -55.28 2.35 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.981 173.382 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -162.95 167.36 37.3 Favored Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.631 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . . . -153.31 135.16 14.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.71 0.29 . . . . 0.0 110.661 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.445 ' HB2' ' CE1' ' A' ' 109' ' ' HIS . 19.0 t -67.4 145.43 55.04 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.336 175.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.7 m -79.11 -0.14 30.39 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.356 178.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.531 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -124.95 -55.78 1.58 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.68 -0.236 . . . . 0.0 111.188 176.528 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 25.4 m -76.37 -26.67 55.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.786 0.327 . . . . 0.0 111.137 -178.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.25 32.68 84.59 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.287 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.44 ' NE2' ' H ' ' A' ' 93' ' ' SER . 0.0 OUTLIER -119.63 162.5 18.87 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.631 0.253 . . . . 0.0 110.406 179.831 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.561 ' OG ' ' HB2' ' A' ' 81' ' ' PHE . 0.7 OUTLIER -78.64 171.09 15.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.998 -178.684 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.705 HG12 HG11 ' A' ' 100' ' ' VAL . 2.3 mp -127.44 119.68 21.84 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.058 -175.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.666 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 7.8 Cg_exo -74.11 167.53 26.96 Favored 'Trans proline' 0 N--CA 1.462 -0.331 0 C-N-CA 122.817 2.345 . . . . 0.0 111.12 171.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.4 -12.4 61.39 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.086 0.469 . . . . 0.0 111.183 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.98 -14.03 34.88 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.168 -179.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.666 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -94.92 102.7 14.55 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.032 0.444 . . . . 0.0 110.966 -174.445 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.418 ' HB3' ' HB2' ' A' ' 408' ' ' PRO . 62.5 mt -71.66 126.59 30.1 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 173.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.705 HG11 HG12 ' A' ' 94' ' ' ILE . 13.8 m -122.25 149.11 25.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.094 -174.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.28 153.75 21.76 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.66 155.46 49.67 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.701 -178.054 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -124.38 -113.4 0.3 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.019 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -92.68 75.46 5.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.111 0.481 . . . . 0.0 110.688 -178.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 86.82 -39.12 3.09 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.748 178.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -89.74 167.22 13.05 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.671 0.272 . . . . 0.0 110.92 -178.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 2.5 m -124.0 160.99 27.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 121.356 0.598 . . . . 0.0 112.588 -173.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . 0.651 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 73.7 m-85 -139.32 -170.26 2.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.654 -1.157 . . . . 0.0 107.977 173.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.831 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 71.7 m80 -112.29 -155.06 0.56 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 173.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -84.36 -25.31 29.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.139 0.495 . . . . 0.0 110.875 178.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.21 -32.84 16.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.084 -175.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.831 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -84.63 -16.34 42.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.655 -172.241 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -78.25 65.09 3.52 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.457 0.646 . . . . 0.0 110.624 179.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.673 HG22 ' HA ' ' A' ' 121' ' ' ARG . 12.1 p -121.35 164.52 16.93 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.892 -178.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.746 ' HB3' ' H ' ' A' ' 120' ' ' ASN . 41.3 t -60.24 152.74 24.02 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.203 172.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -97.97 -14.77 20.42 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.719 178.675 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.98 -50.94 4.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.594 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.56 ' SG ' ' HB3' ' A' ' 140' ' ' ASP . 0.0 OUTLIER -106.63 -11.26 15.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.189 -178.35 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.621 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 61.61 36.2 16.85 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.592 -178.041 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . 0.746 ' H ' ' HB3' ' A' ' 115' ' ' CYS . 1.2 t30 -80.44 130.46 35.17 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 176.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.673 ' HA ' HG22 ' A' ' 114' ' ' THR . 1.6 ttp85 -76.29 117.83 18.37 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.887 0.375 . . . . 0.0 110.602 -177.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.4 mt -66.39 150.81 48.34 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.757 -177.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 11.7 t -131.77 140.95 39.86 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.066 -171.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -56.21 111.03 0.66 Allowed 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.375 2.05 . . . . 0.0 111.074 172.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 116.33 -19.58 13.04 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 -174.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -100.76 167.5 10.27 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 2.2 mtm-85 -106.52 145.89 31.28 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.02 0.438 . . . . 0.0 111.776 -173.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -129.11 149.24 51.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.861 174.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . 0.547 ' HB2' ' HB2' ' A' ' 136' ' ' PHE . 87.8 m-70 -117.06 109.26 16.75 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.535 -177.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.48 ' HA ' ' O ' ' A' ' 134' ' ' SER . 1.6 t80 -92.7 102.22 14.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.066 0.46 . . . . 0.0 109.846 178.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 12.0 mt -123.13 122.66 66.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.874 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 62.3 26.47 15.83 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.665 0.603 . . . . 0.0 111.086 178.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 78.28 34.19 37.51 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.229 -179.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.48 ' O ' ' HA ' ' A' ' 130' ' ' TYR . 0.4 OUTLIER -139.0 152.73 47.88 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -177.859 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 6.3 mt -102.39 114.08 27.96 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.481 -174.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.547 ' HB2' ' HB2' ' A' ' 129' ' ' HIS . 64.9 m-85 -109.44 150.51 27.99 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 174.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . 0.473 ' HB3' ' HB2' ' A' ' 115' ' ' CYS . 11.4 p -114.47 176.13 5.18 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.393 -176.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -68.22 -17.53 64.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.308 -175.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . 0.405 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 26.7 t60 -75.18 -45.94 37.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.114 -176.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.56 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 10.2 p-10 -93.17 -39.48 11.0 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.069 -177.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 24.24 84.86 0.12 Allowed Pre-proline 0 N--CA 1.477 0.911 0 O-C-N 124.507 1.13 . . . . 0.0 113.761 176.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.38 134.29 63.38 Favored 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.767 2.311 . . . . 0.0 112.879 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 1.6 m -104.7 -25.71 12.58 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.102 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -68.63 -50.78 48.69 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.899 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.08 102.09 5.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.63 178.184 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 2.3 tt -135.78 138.33 47.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.982 178.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -83.11 -18.63 38.87 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.068 0.461 . . . . 0.0 111.042 -178.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -139.48 -126.17 2.32 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 178.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . 84.39 -36.67 2.92 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.815 -0.707 . . . . 0.0 113.282 174.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -79.74 -80.02 0.13 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.991 0.424 . . . . 0.0 111.269 -178.67 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . -84.24 103.52 2.61 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.208 -176.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . 89.38 0.22 80.08 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.964 -0.636 . . . . 0.0 111.726 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . 0.427 ' HB2' ' H ' ' A' ' 207' ' ' GLY . 0.7 OUTLIER 54.54 -107.34 0.37 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.09 0.556 . . . . 0.0 111.583 -177.464 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . 0.427 ' H ' ' HB2' ' A' ' 206' ' ' SER . . . -134.36 170.3 22.7 Favored Glycine 0 N--CA 1.448 -0.54 0 N-CA-C 111.295 -0.722 . . . . 0.0 111.295 -178.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.22 140.92 38.91 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.036 0.446 . . . . 0.0 111.274 -175.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 26.7 mm -71.55 146.89 11.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 172.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . 0.433 ' HA ' ' HD3' ' A' ' 406' ' ' PRO . . . -48.28 117.53 5.85 Favored Pre-proline 0 C--N 1.33 -0.26 0 O-C-N 123.313 0.383 . . . . 0.0 110.509 176.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . 0.459 ' O ' ' HB2' ' A' ' 407' ' ' PHE . 14.6 Cg_exo -69.85 8.13 0.86 Allowed 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 123.748 2.965 . . . . 0.0 113.732 -172.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . 0.459 ' HB2' ' O ' ' A' ' 406' ' ' PRO . 33.2 m-85 71.07 159.71 0.16 Allowed Pre-proline 0 C--O 1.234 0.252 0 O-C-N 123.76 0.663 . . . . 0.0 111.248 178.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . 0.418 ' HB2' ' HB3' ' A' ' 99' ' ' LEU . 2.9 Cg_exo -76.28 132.05 13.4 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.791 2.327 . . . . 0.0 111.787 175.27 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -133.32 177.25 7.83 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.823 178.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -85.89 142.27 28.98 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.271 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . 0.485 ' HB2' HG21 ' A' ' 100' ' ' VAL . . . -103.4 -134.15 0.32 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.778 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.467 HD13 ' HA ' ' A' ' 412' ' ' LEU . 1.1 mm? -100.17 124.99 41.29 Favored Pre-proline 0 C--N 1.326 -0.455 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 178.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 412' ' ' LEU . 34.2 Cg_exo -58.79 150.67 69.59 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 123.077 2.518 . . . . 0.0 112.705 179.223 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.526 ' HA ' ' CB ' ' A' ' 84' ' ' SER . 0.3 OUTLIER -67.67 149.78 49.57 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.297 -178.261 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . . . . . . . . . 1.1 m -54.01 113.82 1.37 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.362 0.601 . . . . 0.0 112.134 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -76.05 154.23 84.66 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.627 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -81.99 2.29 8.64 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.827 2.352 . . . . 0.0 112.997 178.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.86 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.302 -179.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.555 0 N-CA-C 111.901 -0.48 . . . . 0.0 111.901 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.76 -61.86 1.51 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.683 0.277 . . . . 0.0 111.461 -177.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -100.57 49.93 0.89 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.784 0.291 . . . . 0.0 111.784 -172.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.513 ' H ' HG13 ' A' ' 78' ' ' ILE . 0.0 OUTLIER -88.88 66.29 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.818 0.342 . . . . 0.0 110.731 179.403 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.715 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER -145.97 13.77 1.31 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.611 -177.697 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.71 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.4 OUTLIER -126.79 169.13 13.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.71 0.29 . . . . 0.0 110.982 -176.538 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 -88.34 114.23 24.75 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.214 -178.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.482 ' HA3' ' CB ' ' A' ' 415' ' ' SER . . . 102.54 -33.92 6.15 Favored Glycine 0 C--N 1.33 0.247 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 -177.113 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.445 HD21 HG23 ' A' ' 78' ' ' ILE . 2.3 t30 67.22 83.82 0.16 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.042 0.756 . . . . 0.0 113.042 172.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.656 ' H ' HD11 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -139.68 -43.06 0.44 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.153 173.446 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . 0.471 ' O ' HG21 ' A' ' 414' ' ' THR . . . -167.76 140.33 6.18 Favored Glycine 0 N--CA 1.452 -0.243 0 N-CA-C 111.114 -0.794 . . . . 0.0 111.114 178.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.71 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . . . -141.18 164.91 28.98 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 117.005 0.403 . . . . 0.0 111.488 -174.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.704 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 37.7 t -65.41 144.49 57.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.357 176.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.82 -15.97 61.62 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.007 178.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.439 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -111.21 -59.35 1.98 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.636 -0.257 . . . . 0.0 111.257 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 10.5 m -74.32 -43.61 56.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.35 0.595 . . . . 0.0 110.729 -179.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.715 ' HA3' ' HE ' ' A' ' 79' ' ' ARG . . . 81.62 12.58 81.49 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.962 -176.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -75.99 148.29 38.19 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.867 0.365 . . . . 0.0 110.854 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.508 ' O ' ' HD3' ' A' ' 95' ' ' PRO . 0.1 OUTLIER -69.55 129.27 39.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.9 176.147 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.5 mt -94.05 108.75 37.65 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-O 120.963 0.411 . . . . 0.0 111.048 -178.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.687 ' HD2' ' HB2' ' A' ' 98' ' ' GLU . 9.5 Cg_exo -72.76 167.19 27.87 Favored 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 122.772 2.314 . . . . 0.0 111.673 175.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.627 ' HB2' ' HB3' ' A' ' 413' ' ' PRO . . . -74.96 -3.76 34.18 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.995 0.426 . . . . 0.0 111.383 -179.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.31 -4.03 30.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.654 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.687 ' HB2' ' HD2' ' A' ' 95' ' ' PRO . 0.3 OUTLIER -94.11 123.4 37.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.304 -174.462 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.6 mt -89.45 114.7 26.22 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 173.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -115.82 141.9 31.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.275 -171.194 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.507 ' HA ' ' HA ' ' A' ' 408' ' ' PRO . 0.0 OUTLIER -82.61 111.39 18.54 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.632 -177.623 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.461 ' H ' ' HG3' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -111.52 127.4 55.7 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.104 -176.538 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.4 ' HA ' ' HG3' ' A' ' 406' ' ' PRO . . . -72.56 -39.15 67.68 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.067 0.461 . . . . 0.0 110.083 176.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.516 ' HB3' ' H ' ' A' ' 105' ' ' GLY . 1.8 tp-100 -171.73 -100.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.656 -179.111 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.516 ' H ' ' HB3' ' A' ' 104' ' ' GLN . . . -83.97 -17.98 64.16 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.934 -0.65 . . . . 0.0 111.724 177.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -101.99 149.4 24.27 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 9.7 p -122.7 148.45 26.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.221 -173.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 39.8 m-85 -139.69 -170.25 2.89 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.656 177.08 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.761 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 69.1 m80 -114.17 -161.59 0.77 Allowed 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 173.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.3 mp -85.35 -19.43 31.46 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.235 0.541 . . . . 0.0 111.037 179.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.498 ' HA ' ' NH1' ' A' ' 121' ' ' ARG . 0.0 OUTLIER -90.16 -38.41 13.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.436 -176.105 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.761 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -76.56 -28.29 56.21 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.366 -174.182 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.45 82.23 0.79 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.038 -179.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.9 HG22 ' HA ' ' A' ' 121' ' ' ARG . 1.1 p -143.97 161.05 39.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.199 -176.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.565 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 1.7 t -67.62 142.23 56.5 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 173.59 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.98 -11.88 51.87 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.869 0.366 . . . . 0.0 111.091 -177.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.489 ' HB ' ' OD2' ' A' ' 140' ' ' ASP . 0.2 OUTLIER -91.62 -51.01 5.46 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -174.813 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.618 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 22.2 p -115.83 -7.42 12.05 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.886 0.374 . . . . 0.0 110.73 -178.245 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.565 ' HA ' ' O ' ' A' ' 115' ' ' CYS . 0.0 OUTLIER 70.99 27.4 3.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.981 -177.065 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . 0.618 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 3.7 t-20 -54.2 119.24 4.85 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.241 172.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.9 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.0 OUTLIER -69.39 108.24 3.65 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 177.277 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.713 HD22 ' HB2' ' A' ' 128' ' ' PHE . 40.4 mt -63.46 137.58 58.2 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -179.082 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 53.9 t -122.59 132.0 24.32 Favored Pre-proline 0 C--N 1.323 -0.573 0 C-N-CA 121.004 -0.279 . . . . 0.0 110.601 -172.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.44 110.88 0.78 Allowed 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.285 1.99 . . . . 0.0 110.638 173.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 110.45 -13.05 30.61 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.604 -175.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -108.0 172.43 6.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.762 0.315 . . . . 0.0 110.293 178.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.723 ' HB3' ' HB3' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -79.15 138.24 37.81 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.056 -174.268 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.713 ' HB2' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -146.8 160.08 42.71 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.051 176.108 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . 0.506 ' HB3' HD11 ' A' ' 131' ' ' ILE . 8.3 m-70 -127.31 134.72 49.98 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.035 0.445 . . . . 0.0 111.035 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.563 ' CZ ' ' HA2' ' A' ' 133' ' ' GLY . 12.9 t80 -124.22 103.21 8.11 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -179.783 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.514 HD12 HD12 ' A' ' 146' ' ' ILE . 0.0 OUTLIER -121.75 117.54 52.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.345 -179.635 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 52.7 t30 57.1 35.87 26.87 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.77 0.669 . . . . 0.0 110.842 177.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.563 ' HA2' ' CZ ' ' A' ' 130' ' ' TYR . . . 75.21 35.53 48.42 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.617 -0.802 . . . . 0.0 113.109 179.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -130.75 139.17 50.23 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 117.126 0.463 . . . . 0.0 110.136 179.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.421 ' HB3' HD11 ' A' ' 122' ' ' LEU . 10.7 mt -94.55 116.14 28.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.081 0.467 . . . . 0.0 110.924 -177.19 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -125.69 159.76 31.43 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.307 177.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . 0.478 ' SG ' ' HB3' ' A' ' 139' ' ' HIS . 21.2 p -91.6 173.08 8.07 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 177.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.723 ' HB3' ' HB3' ' A' ' 127' ' ' ARG . 0.3 OUTLIER -74.76 -14.68 60.74 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 175.535 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . 0.478 ' HB3' ' SG ' ' A' ' 137' ' ' CYS . 15.4 t60 -84.46 -24.19 29.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.517 -177.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.489 ' OD2' ' HB ' ' A' ' 117' ' ' THR . 40.3 m-20 -120.77 17.88 11.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.349 -176.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' A' ' 141' ' ' ARG . 4.5 ptm180 -53.67 120.81 24.42 Favored Pre-proline 0 C--O 1.235 0.305 0 CA-C-O 121.341 0.591 . . . . 0.0 111.307 -176.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 24.3 Cg_exo -64.13 128.99 23.01 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.908 2.405 . . . . 0.0 112.034 -179.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -98.06 -33.93 10.98 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.318 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -96.61 14.63 24.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.452 0.644 . . . . 0.0 110.471 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -146.0 55.93 1.18 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.603 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . 0.514 HD12 HD12 ' A' ' 131' ' ' ILE . 7.0 tt -164.95 -35.85 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.39 -176.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 45.68 69.09 0.49 Allowed 'General case' 0 N--CA 1.47 0.536 0 O-C-N 123.73 0.644 . . . . 0.0 110.95 -175.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . 109.89 -98.81 1.14 Allowed Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 -175.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . 0.441 ' HA2' HG12 ' A' ' 146' ' ' ILE . . . -178.26 170.88 43.18 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.6 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 7.1 m -78.36 80.99 4.73 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 122.45 0.3 . . . . 0.0 110.331 176.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 81.24 -50.59 4.22 Favored Glycine 0 N--CA 1.452 -0.239 0 N-CA-C 111.562 -0.615 . . . . 0.0 111.562 -175.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -152.12 -179.19 27.54 Favored Glycine 0 N--CA 1.441 -1.032 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 177.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.58 74.36 9.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.145 0.498 . . . . 0.0 110.81 179.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 112.17 98.11 2.38 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.343 176.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . 0.408 ' O ' ' HA ' ' A' ' 127' ' ' ARG . 0.4 OUTLIER -90.14 174.88 7.38 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 177.997 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . . . . . . . . . 49.7 mm -104.62 136.16 39.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . . . . . . . . . . . -61.37 124.2 79.66 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.764 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . 0.4 ' HG3' ' HA ' ' A' ' 103' ' ' ALA . 11.5 Cg_endo -57.14 150.85 54.49 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.885 2.39 . . . . 0.0 112.373 178.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -86.03 155.32 58.08 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.321 -174.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . 0.507 ' HA ' ' HA ' ' A' ' 101' ' ' MET . 64.6 Cg_endo -76.49 117.41 4.56 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.586 2.191 . . . . 0.0 112.054 175.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -127.44 166.86 17.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.792 -178.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -74.77 109.92 8.64 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 176.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . . . . . . . . . . . -89.83 -83.78 0.24 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.229 -174.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 412' ' ' LEU . 1.3 pt? -131.47 129.81 22.31 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.784 -176.034 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . 0.627 ' HB3' ' HB2' ' A' ' 96' ' ' ALA . 73.8 Cg_endo -80.68 121.18 4.08 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.509 2.139 . . . . 0.0 111.164 172.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.471 HG21 ' O ' ' A' ' 85' ' ' GLY . 32.4 p -93.47 -126.67 0.1 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -176.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . 0.482 ' CB ' ' HA3' ' A' ' 82' ' ' GLY . 0.3 OUTLIER -90.37 173.11 8.29 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.017 0.437 . . . . 0.0 111.767 -176.428 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -104.93 141.15 21.96 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.558 -178.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -86.94 166.91 8.36 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.758 2.305 . . . . 0.0 113.092 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.981 0 CA-C-O 118.063 -0.97 . . . . 0.0 109.85 175.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.789 0 N-CA-C 112.268 -0.333 . . . . 0.0 112.268 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.32 -172.17 2.88 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 1.8 t80 66.92 79.13 0.24 Allowed 'General case' 0 C--N 1.331 -0.205 0 O-C-N 123.826 0.704 . . . . 0.0 111.606 175.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 1.1 mp -97.06 108.18 21.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.604 0.716 . . . . 0.0 110.223 177.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.607 ' HE ' ' HA3' ' A' ' 91' ' ' GLY . 0.0 OUTLIER -147.9 -1.34 0.59 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.189 176.059 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -132.79 109.3 9.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.707 179.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -78.16 93.89 4.64 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.483 0.659 . . . . 0.0 110.462 -177.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.527 ' HA3' ' HA ' ' A' ' 415' ' ' SER . . . 123.45 -20.11 7.47 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.371 -0.831 . . . . 0.0 111.073 -175.236 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 64.14 18.94 11.55 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.548 0.739 . . . . 0.0 112.302 176.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.406 ' OG ' ' HA ' ' A' ' 414' ' ' THR . 0.2 OUTLIER -91.74 -14.09 30.52 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.848 176.947 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 151.43 170.14 17.92 Favored Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.001 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -167.93 163.81 13.83 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 178.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.607 ' HB3' ' H ' ' A' ' 91' ' ' GLY . 43.3 t -68.5 145.78 53.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.058 0.456 . . . . 0.0 110.111 175.284 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -94.74 -1.71 52.44 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.793 179.11 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.45 ' HB3' ' HB3' ' A' ' 112' ' ' CYS . . . -112.41 -51.68 2.83 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.866 0.365 . . . . 0.0 110.338 177.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . . . . . . . . . 34.8 m -77.78 -52.89 8.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.843 175.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.607 ' H ' ' HB3' ' A' ' 87' ' ' CYS . . . 96.82 1.76 59.9 Favored Glycine 0 N--CA 1.443 -0.845 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.768 -176.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.6 134.88 34.38 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 177.433 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . 0.738 ' HB3' HG21 ' A' ' 414' ' ' THR . 1.0 OUTLIER -65.69 148.3 51.98 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.16 176.735 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.8 mt -103.37 116.18 62.56 Favored Pre-proline 0 C--N 1.324 -0.51 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -168.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -77.53 167.28 24.55 Favored 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.833 2.355 . . . . 0.0 111.028 170.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.08 7.27 6.41 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -176.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.67 -35.67 14.81 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -175.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -96.49 127.32 42.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.881 0.372 . . . . 0.0 110.785 -176.305 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.608 HD23 ' HB2' ' A' ' 408' ' ' PRO . 0.8 OUTLIER -79.69 125.2 29.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.64 176.486 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.834 HG21 ' HB2' ' A' ' 411' ' ' ALA . 29.8 m -115.91 -172.48 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.244 -170.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.8 mmt -122.59 112.7 18.31 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.005 0.431 . . . . 0.0 110.057 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -109.44 119.89 40.83 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.36 -178.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -96.63 -171.8 2.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.1 179.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.488 HE21 ' HB2' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -79.58 63.88 4.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.367 0.603 . . . . 0.0 110.085 177.786 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 168.76 -102.32 0.18 Allowed Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.339 -178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -95.75 178.11 5.56 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.875 0.369 . . . . 0.0 110.729 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 9.6 p -123.76 143.46 36.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.221 0.534 . . . . 0.0 111.659 -174.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . 0.779 ' O ' ' HB ' ' A' ' 100' ' ' VAL . 41.1 m-85 -127.76 -172.84 2.77 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 174.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.878 ' HB2' ' SG ' ' A' ' 112' ' ' CYS . 73.1 m80 -97.76 -164.53 1.15 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 172.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.6 pp -82.15 -23.57 35.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.895 0.379 . . . . 0.0 111.437 -178.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.427 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 0.0 OUTLIER -90.56 -31.03 16.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.075 -175.343 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.878 ' SG ' ' HB2' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -78.79 -5.93 54.63 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.82 -176.342 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -74.33 76.6 1.86 Allowed 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.413 0.625 . . . . 0.0 110.5 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.665 HG22 ' HA ' ' A' ' 121' ' ' ARG . 0.7 OUTLIER -140.7 155.78 46.39 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.801 179.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.533 ' HB2' ' N ' ' A' ' 119' ' ' ARG . 73.0 m -55.78 146.8 20.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.173 0.511 . . . . 0.0 111.369 175.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.73 -20.45 31.09 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.099 -179.586 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.3 -52.59 2.74 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.633 ' SG ' ' HB2' ' A' ' 120' ' ' ASN . 0.1 OUTLIER -94.56 -19.86 20.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.971 0.415 . . . . 0.0 111.08 -174.287 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.533 ' N ' ' HB2' ' A' ' 115' ' ' CYS . 4.9 mmt180 68.82 22.39 7.28 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.936 175.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ASN . . . . . 0.633 ' HB2' ' SG ' ' A' ' 118' ' ' CYS . 1.0 OUTLIER -63.9 130.23 43.26 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 171.725 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.665 ' HA ' HG22 ' A' ' 114' ' ' THR . 0.6 OUTLIER -78.84 107.53 11.63 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.057 177.252 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.766 HD22 ' HA ' ' A' ' 128' ' ' PHE . 10.4 mt -63.99 139.73 58.8 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.441 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.477 ' O ' ' HB3' ' A' ' 405' ' ' ALA . 3.0 t -121.86 132.36 24.25 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.436 -170.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 123' ' ' VAL . 40.0 Cg_exo -55.42 110.72 0.59 Allowed 'Trans proline' 0 N--CA 1.461 -0.431 0 C-N-CA 122.59 2.193 . . . . 0.0 111.288 179.132 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 110.81 -16.29 28.4 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.583 -177.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.485 ' O ' ' HA ' ' A' ' 404' ' ' ILE . 3.3 t70 -116.61 -153.36 0.53 Allowed 'General case' 0 C--N 1.326 -0.423 0 O-C-N 122.665 -0.315 . . . . 0.0 110.641 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.64 139.54 43.65 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -171.221 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.766 ' HA ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -157.74 144.94 18.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.929 -1.032 . . . . 0.0 108.618 170.955 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' HIS . . . . . 0.496 ' CD2' ' HD2' ' A' ' 141' ' ' ARG . 8.3 m-70 -137.35 120.57 16.81 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.425 178.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.427 ' HB2' ' CE2' ' A' ' 128' ' ' PHE . 11.0 t80 -115.68 101.14 8.57 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 175.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -126.71 126.57 68.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.553 -178.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 15.2 t30 58.5 25.72 13.4 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.166 -178.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 78.57 36.38 29.92 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.388 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.571 ' HB2' ' CE2' ' A' ' 136' ' ' PHE . 0.5 OUTLIER -139.55 150.48 45.12 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -179.014 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 43.5 mt -104.22 123.61 47.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.741 0.305 . . . . 0.0 111.489 -174.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.571 ' CE2' ' HB2' ' A' ' 134' ' ' SER . 39.5 m-85 -138.17 178.52 7.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.383 -0.826 . . . . 0.0 108.863 176.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 28.4 p -130.78 -153.18 0.55 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.008 0.432 . . . . 0.0 109.953 174.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.421 ' HA ' ' HD3' ' A' ' 141' ' ' ARG . 1.5 tt0 -77.7 -27.29 50.68 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.458 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -84.17 -53.21 5.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.072 -171.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.553 ' CG ' ' HB3' ' A' ' 118' ' ' CYS . 3.4 p-10 -96.07 31.17 2.21 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.692 0.758 . . . . 0.0 110.741 -178.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.501 ' HA ' ' HD3' ' A' ' 142' ' ' PRO . 0.4 OUTLIER -62.29 126.3 87.54 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.855 179.828 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.501 ' HD3' ' HA ' ' A' ' 141' ' ' ARG . 3.0 Cg_exo -73.93 124.94 9.52 Favored 'Trans proline' 0 N--CA 1.461 -0.42 0 C-N-CA 122.993 2.462 . . . . 0.0 112.205 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.34 53.13 2.69 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.353 0.597 . . . . 0.0 110.905 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -150.43 -77.04 0.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.233 -179.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.69 91.25 7.91 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.769 177.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 12.5 tt -123.71 -26.31 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.47 -178.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 32.7 m-20 67.68 -78.38 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.07 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 201' ' ' GLY . . . . . . . . . . . . . . . -105.33 104.08 2.27 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.856 -0.687 . . . . 0.0 111.769 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 202' ' ' GLY . . . . . . . . . . . . . . . -166.77 92.0 0.1 Allowed Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.61 -178.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 48.8 m -63.57 -53.67 48.03 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.472 0.654 . . . . 0.0 109.95 174.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . -148.22 -56.14 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.643 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 175.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 205' ' ' GLY . . . . . . . . . . . . . . . -94.37 179.13 37.42 Favored Glycine 0 N--CA 1.439 -1.123 0 N-CA-C 110.404 -1.078 . . . . 0.0 110.404 167.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -152.14 92.32 1.7 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 117.046 0.423 . . . . 0.0 110.035 178.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . -79.87 85.44 1.29 Allowed Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 121.051 -0.595 . . . . 0.0 113.14 -174.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 208' ' ' SER . . . . . 0.629 ' HB2' ' O ' ' A' ' 128' ' ' PHE . 4.9 m -107.46 129.6 54.93 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 171.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 404' ' ' ILE . . . . . 0.485 ' HA ' ' O ' ' A' ' 126' ' ' ASP . 50.8 mm -109.81 129.85 63.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.787 -172.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 405' ' ' ALA . . . . . 0.529 ' HB2' ' HB3' ' A' ' 128' ' ' PHE . . . -64.69 134.14 95.93 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.969 179.273 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 406' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 405' ' ' ALA . 5.6 Cg_exo -73.88 -176.48 2.62 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 123.011 2.474 . . . . 0.0 112.053 179.333 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 407' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -107.09 155.54 39.07 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.867 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 408' ' ' PRO . . . . . 0.608 ' HB2' HD23 ' A' ' 99' ' ' LEU . 53.8 Cg_exo -53.12 134.66 57.06 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.813 2.342 . . . . 0.0 112.846 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 409' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.19 175.71 9.33 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.162 -178.155 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 410' ' ' ALA . . . . . . . . . . . . . . . -91.23 134.15 34.8 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.051 178.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 411' ' ' ALA . . . . . 0.834 ' HB2' HG21 ' A' ' 100' ' ' VAL . . . -83.51 178.73 7.88 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.417 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.9 tp -72.45 120.57 81.27 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 174.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 413' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -55.11 121.41 9.86 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.663 2.242 . . . . 0.0 112.06 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.738 HG21 ' HB3' ' A' ' 93' ' ' SER . 0.2 OUTLIER -82.34 162.17 22.31 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.546 179.821 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 415' ' ' SER . . . . . 0.527 ' HA ' ' HA3' ' A' ' 82' ' ' GLY . 24.2 m 71.44 -174.8 0.17 Allowed 'General case' 0 CA--C 1.529 0.169 0 O-C-N 123.753 0.658 . . . . 0.0 110.058 -174.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 416' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -126.27 87.75 55.63 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 417' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -70.45 136.56 31.45 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.791 2.328 . . . . 0.0 111.881 -178.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 418' ' ' LYS . . . . . 0.405 ' H ' ' HG3' ' A' ' 418' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.274 -0.87 . . . . 0.0 110.085 178.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1001 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A 1002 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_